Approximate (EASA-1s) Overlap Similarity Measures, computed with MOLSIMIL 96.
| 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | |
| 1 | 2720.7 | ||||||||||
| 2 | 747.1 | 910.6 | |||||||||
| 3 | 738.7 | 645.1 | 876.7 | ||||||||
| 4 | 740.3 | 672.1 | 642.9 | 876.7 | |||||||
| 5 | 738.7 | 645.9 | 682.8 | 643.9 | 910.5 | ||||||
| 6 | 742.6 | 673.4 | 644.8 | 714.4 | 643.3 | 1048.1 | |||||
| 7 | 1680.3 | 746.1 | 644.9 | 744.8 | 645.1 | 743.9 | 1686.1 | ||||
| 8 | 1722.9 | 739.9 | 529.4 | 736.4 | 679.9 | 696.7 | 1679.3 | 1999.5 | |||
| 9 | 1252.9 | 664.1 | 642.8 | 629.3 | 643.5 | 444.3 | 1413.8 | 1308.0 | 1557.5 | ||
| 10 | 773.0 | 680.5 | 678.3 | 671.9 | 679.9 | 659.6 | 725.4 | 814.0 | 634.1 | 928.0 | |
| 11 | 756.5 | 681.5 | 644.0 | 677.9 | 644.0 | 676.4 | 755.1 | 715.3 | 652.9 | 661.4 | 866.7 |
| 12 | 734.0 | 644.4 | 675.7 | 639.7 | 675.4 | 642.7 | 638.2 | 679.4 | 638.5 | 671.8 | 643.0 |
| 13 | 645.2 | 645.3 | 645.3 | 642.8 | 645.3 | 644.8 | 644.9 | 642.3 | 643.3 | 636.0 | 643.9 |
| 14 | 726.3 | 687.2 | 642.3 | 675.6 | 642.8 | 662.5 | 729.2 | 720.5 | 638.0 | 829.7 | 678.2 |
| 15 | 733.3 | 674.0 | 644.6 | 674.3 | 644.7 | 673.5 | 736.6 | 719.8 | 703.7 | 664.4 | 771.4 |
| 16 | 2239.5 | 583.3 | 555.2 | 590.2 | 555.7 | 461.2 | 1528.7 | 1509.1 | 1253.6 | 560.8 | 554.2 |
| 17 | 1115.0 | 716.7 | 626.2 | 500.7 | 647.6 | 603.6 | 1258.0 | 1140.7 | 858.7 | 351.5 | 597.1 |
| 18 | 1252.1 | 667.1 | 641.7 | 665.0 | 641.5 | 714.8 | 1142.7 | 1195.9 | 892.0 | 447.1 | 673.2 |
| 19 | 737.0 | 682.8 | 644.2 | 683.2 | 644.0 | 642.7 | 739.4 | 738.3 | 684.8 | 671.4 | 727.1 |
| 20 | 698.0 | 644.1 | 673.5 | 640.3 | 673.6 | 643.0 | 639.8 | 686.2 | 641.5 | 681.5 | 643.2 |
| 21 | 614.3 | 622.5 | 612.5 | 618.7 | 615.2 | 616.6 | 617.5 | 605.2 | 618.1 | 597.6 | 614.6 |
| 22 | 724.3 | 645.7 | 676.7 | 642.8 | 677.3 | 644.4 | 644.4 | 685.0 | 633.2 | 680.0 | 643.7 |
| 23 | 3345.2 | 648.8 | 649.0 | 649.1 | 648.9 | 1001.9 | 3257.6 | 3260.7 | 2390.8 | 783.3 | 795.5 |
| 24 | 1342.5 | 573.8 | 567.1 | 570.8 | 567.5 | 568.4 | 1240.5 | 1295.3 | 970.4 | 547.1 | 560.5 |
| 25 | 628.4 | 632.0 | 629.6 | 625.8 | 629.1 | 627.3 | 626.2 | 608.2 | 617.1 | 599.9 | 624.8 |
| 26 | 1341.6 | 542.1 | 543.1 | 531.6 | 542.8 | 538.8 | 1326.8 | 1178.3 | 909.5 | 521.3 | 527.5 |
| 27 | 547.2 | 559.3 | 556.1 | 562.3 | 556.9 | 556.1 | 551.4 | 542.4 | 548.0 | 546.6 | 546.2 |
| 28 | 1164.7 | 668.7 | 626.7 | 593.0 | 630.7 | 398.7 | 1403.7 | 1215.3 | 1433.5 | 630.0 | 559.8 |
| 29 | 715.9 | 660.9 | 633.1 | 668.6 | 634.2 | 505.0 | 719.3 | 548.2 | 590.8 | 669.5 | 568.8 |
| 30 | 729.8 | 685.5 | 644.3 | 684.9 | 644.2 | 671.5 | 729.6 | 729.9 | 705.8 | 674.4 | 677.1 |
| 31 | 722.2 | 692.2 | 644.9 | 690.6 | 644.9 | 681.8 | 711.1 | 722.9 | 698.2 | 684.1 | 703.5 |
| 32 | 746.1 | 672.2 | 641.3 | 674.7 | 641.8 | 671.2 | 746.4 | 746.0 | 700.0 | 677.7 | 691.9 |
| 33 | 655.3 | 636.0 | 617.2 | 639.1 | 617.2 | 635.7 | 653.4 | 621.3 | 624.5 | 616.7 | 635.1 |
| 12 | 13 | 14 | 15 | 16 | 17 | 18 | 19 | 20 | 21 | 22 | |
| 12 | 763.5 | ||||||||||
| 13 | 644.3 | 645.5 | |||||||||
| 14 | 637.9 | 642.0 | 842.7 | ||||||||
| 15 | 643.3 | 644.9 | 655.1 | 796.7 | |||||||
| 16 | 550.2 | 556.4 | 577.4 | 536.0 | 2718.7 | ||||||
| 17 | 671.5 | 643.7 | 420.1 | 559.7 | 1234.7 | 1845.6 | |||||
| 18 | 643.0 | 642.6 | 427.0 | 620.3 | 1296.4 | 1116.9 | 1844.1 | ||||
| 19 | 644.3 | 644.6 | 682.1 | 708.2 | 617.3 | 638.7 | 676.4 | 763.1 | |||
| 20 | 673.8 | 644.1 | 639.1 | 643.0 | 553.8 | 489.1 | 641.1 | 643.5 | 729.2 | ||
| 21 | 611.6 | 618.4 | 613.3 | 622.0 | 712.8 | 606.8 | 627.3 | 626.4 | 610.5 | 766.8 | |
| 22 | 675.8 | 645.1 | 641.4 | 644.5 | 554.5 | 555.2 | 642.1 | 644.3 | 674.6 | 612.6 | 842.7 |
| 23 | 648.5 | 648.8 | 649.2 | 793.7 | 3541.2 | 3171.8 | 3210.4 | 776.7 | 648.7 | 1143.7 | 648.8 |
| 24 | 569.0 | 572.8 | 559.7 | 576.7 | 1674.4 | 1121.7 | 1179.2 | 576.8 | 565.1 | 706.3 | 567.8 |
| 25 | 627.2 | 630.7 | 618.9 | 632.7 | 612.5 | 623.8 | 627.2 | 629.1 | 629.9 | 724.6 | 630.7 |
| 26 | 549.9 | 544.6 | 522.0 | 542.8 | 1669.2 | 1122.2 | 1262.4 | 549.6 | 544.9 | 695.7 | 544.5 |
| 27 | 554.4 | 557.5 | 551.0 | 564.5 | 710.1 | 546.1 | 562.7 | 563.8 | 549.7 | 617.9 | 557.0 |
| 28 | 621.7 | 631.3 | 636.6 | 638.8 | 970.8 | 988.7 | 877.3 | 695.1 | 626.7 | 607.8 | 601.5 |
| 29 | 625.4 | 632.3 | 670.7 | 659.4 | 412.3 | 591.3 | 665.5 | 666.7 | 627.5 | 597.9 | 631.4 |
| 30 | 644.6 | 644.7 | 684.3 | 686.2 | 599.4 | 639.2 | 682.9 | 729.1 | 643.8 | 625.9 | 644.5 |
| 31 | 644.0 | 645.0 | 693.0 | 688.5 | 570.5 | 635.6 | 685.1 | 731.0 | 643.9 | 618.0 | 644.7 |
| 32 | 636.2 | 640.7 | 677.7 | 689.5 | 587.0 | 581.8 | 625.2 | 672.7 | 637.6 | 608.6 | 640.1 |
| 33 | 615.1 | 617.2 | 634.0 | 638.0 | 543.7 | 611.9 | 619.6 | 647.9 | 615.0 | 601.7 | 616.8 |
| 23 | 24 | 25 | 26 | 27 | 28 | 29 | 30 | 31 | 32 | 33 | |
| 23 | 12044.3 | ||||||||||
| 24 | 3560.7 | 1683.9 | |||||||||
| 25 | 914.7 | 602.0 | 762.5 | ||||||||
| 26 | 3571.8 | 1663.9 | 612.7 | 2722.8 | |||||||
| 27 | 661.5 | 719.1 | 591.1 | 677.0 | 679.0 | ||||||
| 28 | 2410.1 | 971.8 | 607.6 | 1178.1 | 553.2 | 1495.4 | |||||
| 29 | 805.8 | 547.8 | 603.7 | 501.3 | 545.2 | 716.7 | 822.0 | ||||
| 30 | 782.9 | 575.8 | 634.6 | 542.3 | 561.8 | 686.5 | 645.1 | 731.2 | |||
| 31 | 1005.8 | 562.1 | 628.9 | 557.6 | 553.8 | 670.6 | 680.1 | 740.0 | 767.3 | ||
| 32 | 649.1 | 556.8 | 616.3 | 517.6 | 548.5 | 694.9 | 672.5 | 675.7 | 686.2 | 779.7 | |
| 33 | 647.3 | 563.5 | 601.9 | 440.4 | 553.9 | 627.7 | 625.4 | 651.0 | 656.0 | 632.6 | 729.1 |