@MOLECULE latrunculol a 64 66 0 0 0 SMALL GASTEIGER @ATOM 1 S -6.0166 0.6930 -0.5735 S.3 1 UNL1111111111 -0.0234 2 O -2.1483 0.3705 -0.2860 O.3 1 UNL1111111111 -0.4526 3 O -1.9847 -1.1413 1.4225 O.3 1 UNL1111111111 -0.5995 4 O 0.3832 -2.0784 -0.4202 O.3 1 UNL1111111111 -0.4796 5 O -5.9159 1.4528 2.0288 O.2 1 UNL1111111111 -0.4613 6 O 1.6726 -3.0561 -1.9697 O.2 1 UNL1111111111 -0.5008 7 O 5.4633 1.6717 1.2914 O.3 1 UNL1111111111 -0.5477 8 O 5.4413 0.7240 -1.1803 O.3 1 UNL1111111111 -0.5700 9 N -4.4781 -0.1920 1.3675 N.am 1 UNL1111111111 -0.5873 10 C -2.4494 -0.9293 0.1137 C.3 1 UNL1111111111 0.4659 11 C -0.7838 0.6499 -0.5942 C.3 1 UNL1111111111 0.1500 12 C -1.9273 -2.0283 -0.8258 C.3 1 UNL1111111111 -0.4224 13 C -0.5632 -1.7148 -1.4378 C.3 1 UNL1111111111 0.1537 14 C -0.3566 -0.2398 -1.7640 C.3 1 UNL1111111111 -0.3748 15 C -4.0127 -0.9724 0.2221 C.3 1 UNL1111111111 0.0606 16 C -0.8245 2.1426 -0.9499 C.3 1 UNL1111111111 -0.3078 17 C -4.6610 -0.4405 -1.0692 C.3 1 UNL1111111111 -0.3687 18 C 0.5506 2.7353 -1.2622 C.3 1 UNL1111111111 -0.2726 19 C 1.4923 2.8041 -0.0430 C.3 1 UNL1111111111 -0.0855 20 C -5.4676 0.7404 1.1724 C.2 1 UNL1111111111 0.5406 21 C 0.9152 3.6575 1.0936 C.3 1 UNL1111111111 -0.4433 22 C 2.7995 3.4215 -0.4568 C.2 1 UNL1111111111 -0.1648 23 C 1.4410 -2.8533 -0.8059 C.2 1 UNL1111111111 0.6371 24 C 4.0026 2.9292 -0.1522 C.2 1 UNL1111111111 -0.2135 25 C 4.2398 1.6517 0.5942 C.3 1 UNL1111111111 0.1237 26 C 4.2634 0.4793 -0.4256 C.3 1 UNL1111111111 0.1068 27 C 2.1431 -3.3845 0.3641 C.2 1 UNL1111111111 -0.3682 28 C 4.3126 -0.8901 0.2552 C.3 1 UNL1111111111 -0.3271 29 C 3.0336 -1.1674 1.0612 C.3 1 UNL1111111111 -0.3036 30 C 2.8601 -2.6477 1.2229 C.2 1 UNL1111111111 0.1675 31 C 3.5486 -3.2699 2.3889 C.3 1 UNL1111111111 -0.4717 32 H -0.1681 0.4641 0.3116 H 1 UNL1111111111 0.1253 33 H -2.6465 -2.2243 -1.6451 H 1 UNL1111111111 0.1677 34 H -1.8560 -2.9742 -0.2400 H 1 UNL1111111111 0.1863 35 H -0.3899 -2.3404 -2.3498 H 1 UNL1111111111 0.1544 36 H 0.7074 -0.0580 -2.0142 H 1 UNL1111111111 0.1702 37 H -0.9311 0.0227 -2.6744 H 1 UNL1111111111 0.1653 38 H -4.3067 -2.0454 0.4046 H 1 UNL1111111111 0.1607 39 H -1.3018 2.6986 -0.1124 H 1 UNL1111111111 0.1663 40 H -1.5061 2.2970 -1.8104 H 1 UNL1111111111 0.1501 41 H -3.9309 0.1158 -1.6912 H 1 UNL1111111111 0.1873 42 H -5.0630 -1.2542 -1.6935 H 1 UNL1111111111 0.1659 43 H 1.0506 2.1667 -2.0709 H 1 UNL1111111111 0.1398 44 H 0.4031 3.7565 -1.6670 H 1 UNL1111111111 0.1446 45 H -3.9041 -0.2072 2.2041 H 1 UNL1111111111 0.3461 46 H 1.6449 1.7648 0.3357 H 1 UNL1111111111 0.1284 47 H -1.0154 -1.2791 1.4457 H 1 UNL1111111111 0.3490 48 H 0.5881 4.6404 0.7392 H 1 UNL1111111111 0.1469 49 H 1.6658 3.8285 1.8759 H 1 UNL1111111111 0.1500 50 H 0.0558 3.1702 1.5652 H 1 UNL1111111111 0.1498 51 H 2.7019 4.3523 -1.0170 H 1 UNL1111111111 0.1479 52 H 4.9188 3.4345 -0.4590 H 1 UNL1111111111 0.1605 53 H 3.5083 1.4828 1.4172 H 1 UNL1111111111 0.1507 54 H 3.4221 0.5584 -1.1503 H 1 UNL1111111111 0.1370 55 H 2.0352 -4.4656 0.4693 H 1 UNL1111111111 0.1870 56 H 5.1966 -0.9450 0.9231 H 1 UNL1111111111 0.1644 57 H 4.4535 -1.6767 -0.5144 H 1 UNL1111111111 0.1550 58 H 2.1522 -0.7198 0.5563 H 1 UNL1111111111 0.1619 59 H 3.0893 -0.6670 2.0513 H 1 UNL1111111111 0.1660 60 H 4.5996 -2.9480 2.4626 H 1 UNL1111111111 0.1697 61 H 3.5516 -4.3685 2.3544 H 1 UNL1111111111 0.1614 62 H 3.0600 -2.9835 3.3343 H 1 UNL1111111111 0.1724 63 H 6.2121 1.7471 0.6571 H 1 UNL1111111111 0.3295 64 H 5.9345 -0.0960 -1.3630 H 1 UNL1111111111 0.3225 @BOND 1 1 17 1 2 1 20 1 3 2 10 1 4 2 11 1 5 3 10 1 6 3 47 1 7 4 13 1 8 4 23 1 9 5 20 2 10 6 23 2 11 7 25 1 12 7 63 1 13 8 26 1 14 8 64 1 15 9 15 1 16 9 20 am 17 9 45 1 18 10 12 1 19 10 15 1 20 11 14 1 21 11 16 1 22 11 32 1 23 12 13 1 24 12 33 1 25 12 34 1 26 13 14 1 27 13 35 1 28 14 36 1 29 14 37 1 30 15 17 1 31 15 38 1 32 16 18 1 33 16 39 1 34 16 40 1 35 17 41 1 36 17 42 1 37 18 19 1 38 18 43 1 39 18 44 1 40 19 21 1 41 19 22 1 42 19 46 1 43 21 48 1 44 21 49 1 45 21 50 1 46 22 24 2 47 22 51 1 48 23 27 1 49 24 25 1 50 24 52 1 51 25 26 1 52 25 53 1 53 26 28 1 54 26 54 1 55 27 30 2 56 27 55 1 57 28 29 1 58 28 56 1 59 28 57 1 60 29 30 1 61 29 58 1 62 29 59 1 63 30 31 1 64 31 60 1 65 31 61 1 66 31 62 1