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final_ic50_vals.txt
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final_ic50_vals.txt
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11GS 11GS00.sdf 50186226 15046.0 0.0 -4.177421057483169
11GS 11GS01.sdf 50186228 992.4000244140625 0.0 -2.996686766284263
11GS 11GS02.sdf 50186229 704.0 0.0 -2.847572659142112
11GS 11GS03.sdf 50186231 11133.3330078125 110568896.0 -4.0466251993938265
11GS 11GS04.sdf 50300261 4000.0 0.0 -3.6020599913279625
11GS 11GS05.sdf 50300262 3600.0 0.0 -3.5563025007672873
11GS 11GS06.sdf 50300263 3900.0 0.0 -3.591064607026499
11GS 11GS07.sdf 50300264 40000.0 0.0 -4.6020599913279625
11GS 11GS08.sdf 50300265 3800.0 0.0 -3.57978359661681
11GS 11GS09.sdf 50300266 5400.0 0.0 -3.7323937598229686
1AO8 1AO800.sdf 18050 12.696552276611328 107.78033447265625 -1.1036858051667806
1AO8 1AO801.sdf 50004544 22.0 0.0 -1.3424226808222062
1AO8 1AO802.sdf 50008291 100000.0 0.0 -5.0
1AO8 1AO803.sdf 50016460 17.80000114440918 128.73333740234375 -1.2504200302308364
1AO8 1AO804.sdf 50016461 23.16666603088379 26.80555534362793 -1.364863537951732
1AO8 1AO805.sdf 50028603 10.0 0.0 -1.0
1AO8 1AO806.sdf 50028604 12.0 0.0 -1.0791812460476249
1AO8 1AO807.sdf 50326674 2500.0 0.0 -3.3979400086720375
1AO8 1AO808.sdf 50326675 2000.0 0.0 -3.3010299956639813
1AO8 1AO809.sdf 50326678 20000.0 0.0 -4.301029995663981
1AO8 1AO810.sdf 50326679 1300.0 0.0 -3.113943352306837
1AO8 1AO811.sdf 50326680 1800.0 0.0 -3.255272505103306
1B6A 1B6A00.sdf 17446 593.0 359576.5 -2.7730546933642626
1B6A 1B6A01.sdf 36588 1.0 0.0 -0.0
1B6A 1B6A02.sdf 36589 0.4000000059604645 0.0 0.3979400022005456
1B6A 1B6A03.sdf 36591 8.0 0.0 -0.9030899869919435
1B6A 1B6A04.sdf 36595 2.0 0.0 -0.3010299956639812
1B6A 1B6A05.sdf 36596 4.0 0.0 -0.6020599913279624
1B6A 1B6A06.sdf 36597 0.10000000149011612 0.0 0.999999993528508
1B6A 1B6A07.sdf 50131563 53600.0 0.0 -4.72916478969277
1B6A 1B6A08.sdf 50137403 0.4300000071525574 0.0 0.3665315371964224
1B6A 1B6A09.sdf 50137405 0.38999998569488525 0.0 0.40893540890332775
1BGQ 1BGQ00.sdf 15361 119.25 6556.6875 -2.0764583877121514
1BGQ 1BGQ03.sdf 68254 79200.0 432640000.0 -4.898725181589493
1BN3 1BN302.sdf 11393 0.9100000262260437 0.0 0.04095859516261421
1BN3 1BN303.sdf 11394 0.8199999928474426 0.0 0.08618615140447382
1BN3 1BN304.sdf 11395 0.9599999785423279 0.0 0.017728776667669817
1BN3 1BN305.sdf 11396 2.25 0.0 -0.3521825181113625
1BN3 1BN307.sdf 11408 1.5199999809265137 0.0 -0.18184358249509497
1BN3 1BN310.sdf 11423 1.5 0.0 -0.17609125905568124
1BNN 1BNN01.sdf 11391 1.2699999809265137 0.0 -0.1038037144335081
1BNN 1BNN03.sdf 11421 1.159999966621399 0.0 -0.06445797673024393
1BNN 1BNN04.sdf 11422 1.0499999523162842 0.0 -0.021189279347295094
1BNN 1BNN05.sdf 11425 0.6000000238418579 0.0 0.22184873235904448
1BNQ 1BNQ00.sdf 10885 24.100000381469727 436.80999755859375 -1.3820170494491504
1BNQ 1BNQ01.sdf 11392 1.2799999713897705 0.0 -0.10720995994063012
1DDU 1DDU00.sdf 18050 60600.0 1728720000.0 -4.782472624166286
1DDU 1DDU01.sdf 20676 69.0 0.0 -1.8388490907372552
1EK2 1EK200.sdf 50124654 223900.0 0.0 -5.35005409357903
1EK2 1EK201.sdf 50124656 100.0 0.0 -2.0
1EK2 1EK202.sdf 50124658 70.79000091552734 0.0 -1.8499719179455822
1EK2 1EK203.sdf 50143908 122000.0 0.0 -5.086359830674748
1EK2 1EK204.sdf 50143911 500000.0 0.0 -5.698970004336019
1EK2 1EK205.sdf 50143914 300000.0 40000000000.0 -5.477121254719663
1EK2 1EK206.sdf 50143925 50.0 0.0 -1.6989700043360187
1EK2 1EK207.sdf 50192936 1900.0 0.0 -3.278753600952829
1EK2 1EK208.sdf 50192966 24000.0 0.0 -4.380211241711606
1EK2 1EK209.sdf 50196665 50.0 0.0 -1.6989700043360187
1EK2 1EK210.sdf 50196667 50.0 0.0 -1.6989700043360187
1EK2 1EK211.sdf 50327823 3.5 0.0 -0.5440680443502757
1FVV 1FVV00.sdf 7744 2.799999952316284 0.0 -0.4471580239462282
1FVV 1FVV01.sdf 7747 5.599999904632568 0.0 -0.7481880196102094
1FVV 1FVV02.sdf 7748 4.599999904632568 0.0 -0.662757822677759
1FVV 1FVV03.sdf 7749 4.699999809265137 0.0 -0.6720978403112281
1FVV 1FVV04.sdf 7751 0.5400000214576721 0.0 0.2676062229197196
1FVV 1FVV05.sdf 7752 4.5 0.0 -0.6532125137753437
1FVV 1FVV06.sdf 7754 4.300000190734863 0.0 -0.6334684748435625
1FVV 1FVV07.sdf 7755 9.850000381469727 0.02250003069639206 -0.9934362473169208
1FVV 1FVV08.sdf 7756 5.599999904632568 0.0 -0.7481880196102094
1FVV 1FVV09.sdf 7757 281.0 0.0 -2.44870631990508
1FVV 1FVV10.sdf 7758 5.599999904632568 0.0 -0.7481880196102094
1FVV 1FVV11.sdf 7760 3.299999952316284 0.0 -0.5185139336025012
1FVV 1FVV12.sdf 7761 75.0 0.0 -1.8750612633917
1FVV 1FVV13.sdf 7766 5.699999809265137 0.0 -0.7558748411400177
1G5S 1G5S00.sdf 5718 6520.4287109375 6952032.5 -3.8142761510499517
1G5S 1G5S01.sdf 7533 601.9931030273438 1078929.375 -2.779591515619411
1GIH 1GIH00.sdf 6619 173.5 23722.75 -2.2392994791268923
1GIH 1GIH01.sdf 6620 14000.0 0.0 -4.146128035678238
1GIH 1GIH02.sdf 6621 12000.0 0.0 -4.079181246047625
1GIH 1GIH03.sdf 6622 17000.0 0.0 -4.230448921378274
1GIH 1GIH04.sdf 6623 9800.0 0.0 -3.9912260756924947
1GIH 1GIH05.sdf 6624 9700.0 0.0 -3.9867717342662448
1GIH 1GIH06.sdf 6625 20000.0 0.0 -4.301029995663981
1GIH 1GIH07.sdf 6628 7500.0 0.0 -3.8750612633917
1GIH 1GIH08.sdf 6629 12000.0 0.0 -4.079181246047625
1GIH 1GIH09.sdf 6630 25000.0 0.0 -4.3979400086720375
1GIH 1GIH10.sdf 6631 25000.0 0.0 -4.3979400086720375
1GIH 1GIH11.sdf 6632 180.0 0.0 -2.255272505103306
1GIH 1GIH12.sdf 6633 440.0 0.0 -2.6434526764861874
1GZ8 1GZ800.sdf 5461 67000.0 0.0 -4.826074802700826
1GZ8 1GZ801.sdf 5462 48000.0 0.0 -4.681241237375588
1GZ8 1GZ802.sdf 5463 49000.0 0.0 -4.690196080028514
1GZ8 1GZ803.sdf 5464 100000.0 0.0 -5.0
1GZ8 1GZ804.sdf 5467 42000.0 0.0 -4.623249290397901
1GZ8 1GZ805.sdf 5468 15000.0 0.0 -4.176091259055681
1GZ8 1GZ806.sdf 5469 26000.0 0.0 -4.414973347970818
1GZ8 1GZ807.sdf 5473 47000.0 0.0 -4.672097857935717
1GZ8 1GZ808.sdf 5477 21000.0 0.0 -4.3222192947339195
1GZ8 1GZ809.sdf 5478 16000.0 0.0 -4.204119982655925
1GZ8 1GZ810.sdf 5483 21000.0 0.0 -4.3222192947339195
1GZ8 1GZ811.sdf 5485 17000.0 0.0 -4.230448921378274
1GZ8 1GZ812.sdf 5490 44000.0 0.0 -4.643452676486188
1H1P 1H1P00.sdf 5462 48000.0 0.0 -4.681241237375588
1H1P 1H1P01.sdf 5463 49000.0 0.0 -4.690196080028514
1H1P 1H1P02.sdf 5464 100000.0 0.0 -5.0
1H1P 1H1P03.sdf 5467 42000.0 0.0 -4.623249290397901
1H1P 1H1P04.sdf 5468 15000.0 0.0 -4.176091259055681
1H1P 1H1P05.sdf 5469 26000.0 0.0 -4.414973347970818
1H1P 1H1P06.sdf 5473 47000.0 0.0 -4.672097857935717
1H1P 1H1P07.sdf 5483 21000.0 0.0 -4.3222192947339195
1H1P 1H1P08.sdf 5485 17000.0 0.0 -4.230448921378274
1H1P 1H1P09.sdf 5490 44000.0 0.0 -4.643452676486188
1H1P 1H1P10.sdf 5522 5000.0 0.0 -3.6989700043360187
1H1Q 1H1Q01.sdf 5531 2300.0 0.0 -3.361727836017593
1H1Q 1H1Q09.sdf 5548 100.0 0.0 -2.0
1H1R 1H1R01.sdf 5533 6800.0 0.0 -3.832508912706236
1H1R 1H1R02.sdf 5534 12000.0 0.0 -4.079181246047625
1H1R 1H1R04.sdf 5537 1800.0 0.0 -3.255272505103306
1H1R 1H1R05.sdf 5538 1700.0 0.0 -3.230448921378274
1H1S 1H1S06.sdf 5544 6.3000006675720215 1.6200003623962402 -0.7993405954730786
1H1S 1H1S07.sdf 5545 7.0 0.0 -0.8450980400142568
1H1S 1H1S08.sdf 5546 56.0 0.0 -1.7481880270062005
1H1S 1H1S09.sdf 5547 63.0 0.0 -1.7993405494535817
1H1S 1H1S11.sdf 5549 70.0 0.0 -1.845098040014257
1H1S 1H1S12.sdf 5550 210.0 0.0 -2.322219294733919
1HFC 1HFC00.sdf 50031795 8.300000190734863 0.0 -0.9190781023562061
1HFC 1HFC01.sdf 50069599 3000.0 0.0 -3.4771212547196626
1HFC 1HFC02.sdf 50109169 25.0 0.0 -1.3979400086720377
1HFC 1HFC03.sdf 50245248 4100.0 0.0 -3.6127838567197355
1I91 1I9102.sdf 11397 1.659999966621399 0.0 -0.22010807930743917
1I91 1I9103.sdf 11398 1.1699999570846558 0.0 -0.06818584581633469
1I91 1I9104.sdf 11399 1.1100000143051147 0.0 -0.04532298438362352
1I91 1I9105.sdf 11400 1.1100000143051147 0.0 -0.04532298438362352
1I91 1I9106.sdf 11401 1.0399999618530273 0.0 -0.017033323368953402
1I91 1I9107.sdf 11406 1.2400000095367432 0.0 -0.09342168850236
1I91 1I9108.sdf 11409 1.4600000381469727 0.0 -0.16435286713171074
1I91 1I9109.sdf 11411 0.9900000095367432 0.0 0.004364801218859265
1I91 1I9113.sdf 11424 1.6200000047683716 0.0 -0.20951501582095036
1IF4 1IF400.sdf 10862 3000.0 0.0 -3.4771212547196626
1IF4 1IF406.sdf 50155502 3600.0 0.0 -3.5563025007672873
1IPC 1IPC01.sdf 50316304 14000.0 0.0 -4.146128035678238
1IPC 1IPC02.sdf 50316305 15500.0 0.0 -4.190331698170292
1IPC 1IPC03.sdf 50316307 10000.0 0.0 -4.0
1IPC 1IPC04.sdf 50316308 56800.0 0.0 -4.754348335711019
1IPC 1IPC05.sdf 50316309 54500.0 0.0 -4.7363965022766426
1IYK 1IYK01.sdf 50057678 520.0 0.0 -2.716003343634799
1IYK 1IYK02.sdf 50057680 750.0 0.0 -2.8750612633917
1IYK 1IYK03.sdf 50057682 340.0 0.0 -2.531478917042255
1IYK 1IYK04.sdf 50057684 110.0 0.0 -2.041392685158225
1IYK 1IYK05.sdf 50057686 5000.0 0.0 -3.6989700043360187
1IYK 1IYK06.sdf 50057689 750.0 0.0 -2.8750612633917
1IYK 1IYK07.sdf 50057693 190.0 0.0 -2.278753600952829
1IYK 1IYK08.sdf 50057701 110000.0 0.0 -5.041392685158225
1IYK 1IYK09.sdf 50057702 43.0 0.0 -1.6334684555795866
1IYK 1IYK10.sdf 50057703 10000.0 0.0 -4.0
1IYK 1IYK11.sdf 50057706 8200.0 0.0 -3.9138138523837167
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1J3J 1J3J01.sdf 18775 60100.0 0.0 -4.778874472002739
1J3J 1J3J02.sdf 18779 12700.0 0.0 -4.103803720955957
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1J3J 1J3J07.sdf 18789 30800.0 0.0 -4.488550716500444
1J3J 1J3J08.sdf 50110765 22500.0 0.0 -4.352182518111363
1JLQ 1JLQ00.sdf 1759 21000.0 0.0 -4.3222192947339195
1JLQ 1JLQ01.sdf 1760 10000.0 0.0 -4.0
1JLQ 1JLQ02.sdf 1765 9772.0 0.0 -3.989983458301399
1JLQ 1JLQ03.sdf 1766 15000.0 0.0 -4.176091259055681
1JLQ 1JLQ04.sdf 1769 501.0 0.0 -2.699837725867246
1JLQ 1JLQ05.sdf 1781 6918.0 0.0 -3.839980557678343
1JLQ 1JLQ06.sdf 1785 4467.0 0.0 -3.6500159524718385
1JLQ 1JLQ07.sdf 1786 200.0 0.0 -2.3010299956639813
1JLQ 1JLQ08.sdf 1787 7244.0 0.0 -3.8599784416420206
1JLQ 1JLQ09.sdf 1796 6026.0 0.0 -3.7800291273373383
1JLQ 1JLQ10.sdf 1797 1820.0 0.0 -3.2600713879850747
1JLQ 1JLQ11.sdf 1798 18000.0 0.0 -4.2552725051033065
1JLQ 1JLQ12.sdf 1799 5248.0 0.0 -3.719993826367604
1JLQ 1JLQ13.sdf 1802 7.099999904632568 0.0 -0.8512583428856175
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1KAK 1KAK01.sdf 50070000 130000.0 0.0 -5.113943352306837
1KAK 1KAK02.sdf 50070001 112000.0 0.0 -5.049218022670182
1KAK 1KAK03.sdf 50070002 500000.0 0.0 -5.698970004336019
1KAK 1KAK04.sdf 50070003 29000.0 0.0 -4.462397997898956
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1KAK 1KAK08.sdf 50239833 120.0 0.0 -2.0791812460476247
1KAV 1KAV00.sdf 50075304 449900.0 0.0 -5.653115993165567
1KAV 1KAV01.sdf 50075305 128300.0 0.0 -5.108226656374929
1KAV 1KAV02.sdf 50075308 778900.0 0.0 -5.89148170383952
1KAV 1KAV03.sdf 50075313 77500.0 0.0 -4.889301702506311
1KAV 1KAV05.sdf 50142308 2095.0 2907025.0 -3.3211840273023143
1KAV 1KAV06.sdf 50142309 3715.0 8497225.0 -3.569958818096594
1KAV 1KAV07.sdf 50142311 582.5 317218.75 -2.7652959296980564
1KAV 1KAV08.sdf 50142313 880.0 592900.0 -2.9444826721501687
1KAV 1KAV10.sdf 50224551 1200.0 0.0 -3.0791812460476247
1KE6 1KE600.sdf 7743 7.099999904632568 0.0 -0.8512583428856175
1KE6 1KE601.sdf 7744 2.799999952316284 0.0 -0.4471580239462282
1KE6 1KE602.sdf 7745 1.600000023841858 0.0 -0.20411998912741683
1KE6 1KE603.sdf 7747 5.599999904632568 0.0 -0.7481880196102094
1KE6 1KE604.sdf 7748 4.599999904632568 0.0 -0.662757822677759
1KE6 1KE605.sdf 7754 4.300000190734863 0.0 -0.6334684748435625
1KE6 1KE606.sdf 7760 3.299999952316284 0.0 -0.5185139336025012
1KE6 1KE607.sdf 7761 75.0 0.0 -1.8750612633917
1KE6 1KE608.sdf 7766 5.699999809265137 0.0 -0.7558748411400177
1KE6 1KE609.sdf 7767 7.5 0.0 -0.8750612633917001
1KE6 1KE610.sdf 7768 26.0 0.0 -1.414973347970818
1KE6 1KE611.sdf 7769 5.699999809265137 0.0 -0.7558748411400177
1KE6 1KE612.sdf 7770 13.0 0.0 -1.1139433523068367
1KE7 1KE700.sdf 7686 2.299999952316284 0.0 -0.3617278270137777
1KE7 1KE701.sdf 7687 2.5 0.0 -0.3979400086720376
1KE7 1KE704.sdf 7717 2.0999999046325684 0.0 -0.3222192750112763
1KE7 1KE705.sdf 7719 1.899999976158142 0.0 -0.2787535955031514
1KE7 1KE706.sdf 7771 50.0 0.0 -1.6989700043360187
1KE7 1KE707.sdf 7772 14.0 0.0 -1.146128035678238
1KE7 1KE708.sdf 7773 8.899999618530273 0.0 -0.9493899880302835
1KE9 1KE900.sdf 7682 690.0 0.0 -2.838849090737255
1KE9 1KE901.sdf 7683 360.0 0.0 -2.5563025007672873
1KE9 1KE902.sdf 7685 22.0 0.0 -1.3424226808222062
1KE9 1KE903.sdf 7702 54.0 0.0 -1.7323937598229686
1KE9 1KE904.sdf 7712 310.0 0.0 -2.4913616938342726
1KE9 1KE905.sdf 7716 28.0 0.0 -1.4471580313422192
1KE9 1KE906.sdf 7732 61.0 0.0 -1.7853298350107671
1KE9 1KE907.sdf 7762 560.0 0.0 -2.7481880270062002
1KE9 1KE908.sdf 7763 1000.0 0.0 -3.0
1KE9 1KE909.sdf 7764 1000.0 0.0 -3.0
1KE9 1KE910.sdf 7765 660.0 0.0 -2.8195439355418688
1KLM 1KLM00.sdf 1944 11507.947265625 569789952.0 -4.060997863098325
1KLM 1KLM01.sdf 1947 1325.0 381875.0 -3.1222158782728267
1KLM 1KLM02.sdf 1951 3100.0 0.0 -3.4913616938342726
1KLM 1KLM03.sdf 1956 273.3333435058594 9088.8896484375 -2.436692613827
1KLM 1KLM04.sdf 1961 393.3333435058594 822.2222290039062 -2.5947607638183405
1KLM 1KLM05.sdf 1965 380.0 0.0 -2.57978359661681
1KLM 1KLM06.sdf 2291 1200.0 0.0 -3.0791812460476247
1KLM 1KLM07.sdf 2295 1000.0 0.0 -3.0
1KLM 1KLM08.sdf 2303 1800.0 0.0 -3.255272505103306
1KLM 1KLM09.sdf 2306 8300.0 0.0 -3.9190780923760737
1KLM 1KLM10.sdf 2307 500.0 0.0 -2.6989700043360187
1KLM 1KLM11.sdf 2310 5600.0 0.0 -3.7481880270062002
1L8B 1L8B00.sdf 50294220 12200.0 30420000.0 -4.086359830674748
1L8B 1L8B01.sdf 50294221 2050.0 1172500.0 -3.311753861055754
1L8B 1L8B02.sdf 50294222 5630.0 2810466.75 -3.7505083948513462
1L8B 1L8B05.sdf 50316304 39000.0 0.0 -4.5910646070264995
1L8B 1L8B06.sdf 50316305 26800.0 0.0 -4.4281347940287885
1L8B 1L8B07.sdf 50316307 49800.0 0.0 -4.697229342759718
1LD8 1LD800.sdf 14009 219.0 92880.5 -2.3404441148401185
1LD8 1LD801.sdf 14010 1950.800048828125 3799380.75 -3.2902127577898304
1N7I 1N7I00.sdf 13014 2505.75 18721270.0 -3.398937739029831
1N7I 1N7I02.sdf 50028901 2000.0 0.0 -3.3010299956639813
1N7I 1N7I03.sdf 50028905 50000.0 0.0 -4.698970004336019
1N7I 1N7I04.sdf 50028906 10000.0 0.0 -4.0
1N7I 1N7I05.sdf 50028908 100.0 0.0 -2.0
1N7I 1N7I06.sdf 50028910 1000.0 0.0 -3.0
1N7I 1N7I07.sdf 50028911 2000.0 0.0 -3.3010299956639813
1N7I 1N7I08.sdf 50028912 7000.0 0.0 -3.845098040014257
1N7I 1N7I09.sdf 50028913 5000.0 0.0 -3.6989700043360187
1N7I 1N7I10.sdf 50028914 2000.0 0.0 -3.3010299956639813
1N7I 1N7I11.sdf 50029099 300.0 0.0 -2.4771212547196626
1N7I 1N7I12.sdf 50029101 200.0 0.0 -2.3010299956639813
1N7I 1N7I13.sdf 50029108 100.0 0.0 -2.0
1NAX 1NAX00.sdf 18868 20.926666259765625 0.0026889184955507517 -1.3207000481998783
1NAX 1NAX01.sdf 18869 1.100000023841858 0.0 -0.041392694571304324
1NAX 1NAX02.sdf 18870 0.15066666901111603 2.222164994236664e-07 0.8219828131504391
1NAX 1NAX03.sdf 18913 0.20000000298023224 0.0 0.6989699978645267
1NAX 1NAX04.sdf 18920 2.8866665363311768 8.888871525414288e-05 -0.46039661768891327
1NAX 1NAX05.sdf 18926 10.973332405090332 0.0003555548610165715 -1.0403385350832524
1NAX 1NAX06.sdf 18929 50.07999801635742 0.003199943108484149 -1.6996643030001959
1NAX 1NAX07.sdf 18930 75.57333374023438 0.16435576975345612 -1.878368580522046
1NAX 1NAX08.sdf 18931 87.0666732788086 0.0022221545223146677 -1.9398519508651884
1NAX 1NAX09.sdf 18934 123.35333251953125 0.20908941328525543 -2.0911508869047415
1NAX 1NAX10.sdf 18935 67.40666961669922 0.08268905431032181 -1.8287028703397983
1NAX 1NAX11.sdf 18937 7.730000019073486 0.0009000126156024635 -0.8881794949899303
1NAX 1NAX12.sdf 50171807 2140.0 0.0 -3.330413773349191
1NHG 1NHG00.sdf 8726 136.5 4032.25 -2.1351326513767748
1NHG 1NHG06.sdf 25420 76.0 0.0 -1.8808135922807914
1NHG 1NHG07.sdf 50174765 360.0 0.0 -2.5563025007672873
1NHG 1NHG08.sdf 50174767 190.0 0.0 -2.278753600952829
1NHG 1NHG09.sdf 50174768 220.0 0.0 -2.342422680822206
1NHG 1NHG10.sdf 50174775 120.0 0.0 -2.0791812460476247
1NHG 1NHG11.sdf 50182380 7000.0 0.0 -3.845098040014257
1NLJ 1NLJ00.sdf 19769 73.33333587646484 22.22222328186035 -1.8653014411634705
1NLJ 1NLJ06.sdf 19778 0.5 0.0 0.3010299956639812
1NVR 1NVR00.sdf 2579 350.7333068847656 611987.1875 -2.544977009991618
1NVR 1NVR01.sdf 6763 15.0 0.0 -1.1760912590556813
1NVR 1NVR02.sdf 17054 9.899999618530273 0.0 -0.9956351778631862
1NVR 1NVR04.sdf 50245342 3.0 0.0 -0.47712125471966244
1NVR 1NVR05.sdf 50245343 30.0 0.0 -1.4771212547196624
1NVR 1NVR06.sdf 50280450 7.800000190734863 4.840000152587891 -0.8920946133103647
1NVS 1NVS06.sdf 50260339 5000.0 0.0 -3.6989700043360187
1NVS 1NVS07.sdf 50260343 14.0 0.0 -1.146128035678238
1NVS 1NVS08.sdf 50260358 27.0 0.0 -1.4313637641589874
1O44 1O4400.sdf 14690 3.0 0.0 -0.47712125471966244
1O44 1O4401.sdf 14691 0.25 0.0 0.6020599913279624
1O44 1O4402.sdf 14694 450.0 0.0 -2.6532125137753435
1O44 1O4403.sdf 14696 120.0 0.0 -2.0791812460476247
1O44 1O4404.sdf 14698 2200.0 0.0 -3.342422680822206
1O49 1O4900.sdf 14695 437.0 0.0 -2.640481436970422
1O49 1O4901.sdf 14697 2000.0 0.0 -3.3010299956639813
1OGU 1OGU00.sdf 5566 2200.0 0.0 -3.342422680822206
1OGU 1OGU01.sdf 5589 59000.0 0.0 -4.770852011642144
1OGU 1OGU02.sdf 5590 2900.0 0.0 -3.462397997898956
1OGU 1OGU03.sdf 5591 500.0 0.0 -2.6989700043360187
1OGU 1OGU04.sdf 5592 220.0 0.0 -2.342422680822206
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1OGU 1OGU06.sdf 5594 34.0 0.0 -1.5314789170422551
1OGU 1OGU07.sdf 5595 1.100000023841858 0.0 -0.041392694571304324
1OIQ 1OIQ00.sdf 7641 4000.0 0.0 -3.6020599913279625
1OIQ 1OIQ01.sdf 7642 2892.0 64.0 -3.461198288622493
1OIQ 1OIQ02.sdf 7643 95249.5 62250.25 -4.978862704580614
1OIQ 1OIQ03.sdf 7644 10000.0 0.0 -4.0
1OIQ 1OIQ04.sdf 7645 36.0 0.0 -1.5563025007672873
1OIQ 1OIQ05.sdf 7646 18.75 185.6875 -1.2730012720637376
1OIQ 1OIQ06.sdf 7647 3.0 0.0 -0.47712125471966244
1OIQ 1OIQ07.sdf 7651 8800.0 0.0 -3.9444826721501687
1OIQ 1OIQ08.sdf 7652 150.0 0.0 -2.1760912590556813
1OIQ 1OIQ09.sdf 7653 620.0 0.0 -2.792391689498254
1OIQ 1OIQ10.sdf 7655 3.0 0.0 -0.47712125471966244
1OIQ 1OIQ11.sdf 7656 5.0 0.0 -0.6989700043360189
1OIQ 1OIQ12.sdf 7657 2.0 0.6666666865348816 -0.3010299956639812
1OIR 1OIR08.sdf 7658 3.0 0.0 -0.47712125471966244
1OIR 1OIR09.sdf 7660 4.0 0.0 -0.6020599913279624
1OIY 1OIY00.sdf 5530 970.0 0.0 -2.9867717342662448
1OIY 1OIY01.sdf 5536 400.0 0.0 -2.6020599913279625
1OIY 1OIY02.sdf 5541 534.5 216690.25 -2.727947709544797
1OIY 1OIY03.sdf 5542 650.0 0.0 -2.8129133566428557
1OIY 1OIY04.sdf 5551 64.0 0.0 -1.806179973983887
1OIY 1OIY05.sdf 5552 200.0 0.0 -2.3010299956639813
1OIY 1OIY06.sdf 5553 200.0 0.0 -2.3010299956639813
1OIY 1OIY07.sdf 5554 300.0 0.0 -2.4771212547196626
1OIY 1OIY08.sdf 5555 800.0 0.0 -2.9030899869919438
1OIY 1OIY09.sdf 5557 130.0 0.0 -2.113943352306837
1OIY 1OIY10.sdf 5558 300.0 0.0 -2.4771212547196626
1OQ5 1OQ500.sdf 11639 21.0 0.0 -1.3222192947339193
1OQ5 1OQ501.sdf 13064 100000.0 0.0 -5.0
1OQ5 1OQ502.sdf 13065 100000.0 0.0 -5.0
1OQ5 1OQ503.sdf 13067 21.399999618530273 0.0 -1.3304137656075927
1P2A 1P2A00.sdf 10115 18.0 0.0 -1.255272505103306
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1P2A 1P2A02.sdf 10121 54.0 0.0 -1.7323937598229686
1P2A 1P2A03.sdf 10122 12.0 0.0 -1.0791812460476249
1P2A 1P2A04.sdf 10123 48.0 0.0 -1.6812412373755872
1P2A 1P2A05.sdf 10124 65.0 0.0 -1.8129133566428555
1P2A 1P2A06.sdf 10125 294.0 0.0 -2.4683473304121573
1P2A 1P2A07.sdf 10126 127.0 0.0 -2.103803720955957
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1P2A 1P2A09.sdf 10135 204.0 0.0 -2.3096301674258988
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1P2A 1P2A11.sdf 10137 72.0 0.0 -1.8573324964312685
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1Q6N 1Q6N02.sdf 13815 109.0 0.0 -2.037426497940624
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1Q6N 1Q6N05.sdf 50142325 41.0 441.0 -1.6127838567197355
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1Q6P 1Q6P05.sdf 13600 10.0 0.0 -1.0
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1Q6P 1Q6P07.sdf 13602 12.0 0.0 -1.0791812460476249
1Q6P 1Q6P08.sdf 50142326 222.0 21904.0 -2.346352974450639
1Q6P 1Q6P09.sdf 50142328 47.5 1332.25 -1.6766936096248666
1Q6S 1Q6S06.sdf 13603 6.0 0.0 -0.7781512503836436
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1Q6S 1Q6S08.sdf 13605 11.0 0.0 -1.041392685158225
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1R78 1R7800.sdf 10096 21.0 0.0 -1.3222192947339193
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1R78 1R7802.sdf 10098 4.0 0.0 -0.6020599913279624
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2CMA 2CMA01.sdf 13488 2600.0 0.0 -3.4149733479708178
2CMA 2CMA02.sdf 13489 300.0 0.0 -2.4771212547196626
2CMA 2CMA03.sdf 13491 3200.0 0.0 -3.505149978319906
2CMA 2CMA04.sdf 13492 600.0 0.0 -2.7781512503836434
2CMA 2CMA06.sdf 13808 185.0 0.0 -2.2671717284030137
2CMA 2CMA07.sdf 13809 65.0 0.0 -1.8129133566428555
2CMA 2CMA08.sdf 13811 3000.0 0.0 -3.4771212547196626
2CMA 2CMA09.sdf 13812 16000.0 0.0 -4.204119982655925
2CMA 2CMA10.sdf 14268 35.0 0.0 -1.5440680443502757
2CMA 2CMA11.sdf 50189674 940.0 0.0 -2.9731278535996988
2CMA 2CMA12.sdf 50228011 5030.0 0.0 -3.7015679850559273
2CMA 2CMA13.sdf 50341990 40.0 0.0 -1.6020599913279625
2CMC 2CMC00.sdf 13468 33000.0 0.0 -4.518513939877887
2CMC 2CMC01.sdf 13469 1.7000000476837158 0.0 -0.23044893355990592
2CMC 2CMC02.sdf 13470 46.0 0.0 -1.662757831681574
2CMC 2CMC03.sdf 13471 42.0 0.0 -1.6232492903979006
2CMC 2CMC04.sdf 13472 1725.0 625.0 -3.236789099409293
2CMC 2CMC05.sdf 50107743 4400.0 0.0 -3.6434526764861874
2CMC 2CMC06.sdf 50131104 1410.0 0.0 -3.1492191126553797
2CMC 2CMC07.sdf 50131550 2.4000000953674316 0.0 -0.3802112589689179
2CMC 2CMC08.sdf 50142314 6666.66650390625 43555556.0 -3.823908730341426
2CNF 2CNF00.sdf 13473 255.0 225.0 -2.406540180433955
2CNF 2CNF01.sdf 13480 420.0 0.0 -2.6232492903979003
2CNF 2CNF02.sdf 13481 970.0 0.0 -2.9867717342662448
2CNF 2CNF03.sdf 13485 500.0 0.0 -2.6989700043360187
2CNF 2CNF04.sdf 13486 840.0 0.0 -2.9242792860618816
2CNF 2CNF05.sdf 13487 1100.0 0.0 -3.041392685158225
2CNF 2CNF06.sdf 14270 480.0 0.0 -2.681241237375587
2CNF 2CNF08.sdf 14276 490.0 0.0 -2.690196080028514
2CNF 2CNF09.sdf 14277 420.0 0.0 -2.6232492903979003
2CNF 2CNF10.sdf 14279 440.0 0.0 -2.6434526764861874
2CNF 2CNF11.sdf 14280 970.0 0.0 -2.9867717342662448
2CNF 2CNF12.sdf 14284 470.0 0.0 -2.6720978579357175
2CNF 2CNF13.sdf 14285 1100.0 0.0 -3.041392685158225
2CNF 2CNF14.sdf 14286 500.0 0.0 -2.6989700043360187
2CNF 2CNF15.sdf 14290 410.0 0.0 -2.6127838567197355
2CNF 2CNF16.sdf 14291 470.0 0.0 -2.6720978579357175
2CNG 2CNG00.sdf 13474 110.0 0.0 -2.041392685158225
2CNG 2CNG03.sdf 13490 200.0 0.0 -2.3010299956639813
2CNG 2CNG07.sdf 14289 150.0 0.0 -2.1760912590556813
2CNG 2CNG08.sdf 50189646 140.0 0.0 -2.146128035678238
2CNG 2CNG09.sdf 50189647 53.0 0.0 -1.7242758696007892
2CNG 2CNG10.sdf 50189655 51.0 0.0 -1.7075701760979363
2CNG 2CNG11.sdf 50189662 160.0 0.0 -2.204119982655925
2CNH 2CNH00.sdf 13475 59.0 0.0 -1.7708520116421442
2CNH 2CNH01.sdf 13496 80.0 0.0 -1.9030899869919435
2CNH 2CNH02.sdf 13498 100.0 0.0 -2.0
2CNH 2CNH03.sdf 13499 110.0 0.0 -2.041392685158225
2CNH 2CNH04.sdf 13500 120.0 0.0 -2.0791812460476247
2CNH 2CNH05.sdf 13501 120.0 0.0 -2.0791812460476247
2CNH 2CNH06.sdf 13505 220.0 0.0 -2.342422680822206
2CNH 2CNH07.sdf 13506 300.0 0.0 -2.4771212547196626
2CNH 2CNH08.sdf 50189642 32.0 0.0 -1.505149978319906
2CNH 2CNH09.sdf 50189649 45.0 0.0 -1.6532125137753437
2CNH 2CNH10.sdf 50189658 48.0 0.0 -1.6812412373755872
2CNH 2CNH11.sdf 50189660 94.0 0.0 -1.9731278535996986
2CNH 2CNH12.sdf 50189677 80.0 0.0 -1.9030899869919435
2CNH 2CNH13.sdf 50189681 80.0 0.0 -1.9030899869919435
2CNH 2CNH14.sdf 50189685 300.0 0.0 -2.4771212547196626
2D0T 2D0T00.sdf 24656 109550.0 20431980544.0 -5.039612381896724
2D0T 2D0T01.sdf 24663 3600.0 2880000.0 -3.5563025007672873
2D0T 2D0T02.sdf 24664 5300.0 0.0 -3.724275869600789
2D0T 2D0T03.sdf 24665 7600.0 0.0 -3.8808135922807914
2D0T 2D0T04.sdf 24666 7700.0 0.0 -3.886490725172482
2D0T 2D0T05.sdf 24667 25000.0 0.0 -4.3979400086720375
2D0T 2D0T06.sdf 24671 123000.0 0.0 -5.089905111439398
2D0T 2D0T07.sdf 24672 179000.0 0.0 -5.252853030979893
2D0T 2D0T08.sdf 24673 209000.0 0.0 -5.320146286111054
2D0T 2D0T09.sdf 24674 365000.0 0.0 -5.562292864456475