@MOLECULE varespladib methyl 51 53 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.5549 -0.9375 0.1569 O.3 1 UNL1111111111 -0.3067 2 O -1.9857 1.7602 -1.4510 O.2 1 UNL1111111111 -0.3687 3 O -0.2863 3.2219 0.8486 O.2 1 UNL1111111111 -0.5239 4 O -4.5742 0.4011 1.1122 O.3 1 UNL1111111111 -0.4122 5 O -5.8614 -0.6584 -0.4027 O.2 1 UNL1111111111 -0.4716 6 N 1.8366 -0.5872 -1.0850 N.ar 1 UNL1111111111 -0.2927 7 N -1.9606 1.9157 1.6471 N.am 1 UNL1111111111 -0.6629 8 C 1.2211 0.6694 -1.0451 C.ar 1 UNL1111111111 0.2086 9 C 0.9071 -1.5633 -0.7178 C.ar 1 UNL1111111111 0.1376 10 C -0.3392 -0.9014 -0.4960 C.ar 1 UNL1111111111 -0.1058 11 C -0.1194 0.4940 -0.7224 C.ar 1 UNL1111111111 -0.2822 12 C 3.2620 -0.8202 -1.2683 C.3 1 UNL1111111111 -0.0851 13 C 1.9405 1.9345 -1.3191 C.3 1 UNL1111111111 -0.2843 14 C -1.4408 -1.6803 -0.1028 C.ar 1 UNL1111111111 0.2708 15 C 1.0442 -2.9539 -0.5808 C.ar 1 UNL1111111111 -0.2617 16 C 4.0515 -0.4478 -0.0378 C.ar 1 UNL1111111111 -0.0434 17 C -1.1450 1.5199 -0.6295 C.2 1 UNL1111111111 0.4354 18 C -1.3202 -3.0518 0.0337 C.ar 1 UNL1111111111 -0.3279 19 C 1.9119 2.2574 -2.8128 C.3 1 UNL1111111111 -0.4209 20 C -0.0766 -3.6713 -0.2120 C.ar 1 UNL1111111111 -0.0572 21 C 3.6559 -0.9115 1.2174 C.ar 1 UNL1111111111 -0.1439 22 C 5.1814 0.3603 -0.1622 C.ar 1 UNL1111111111 -0.1655 23 C -1.0812 2.3222 0.6781 C.2 1 UNL1111111111 0.5060 24 C -3.7714 -1.6619 0.3066 C.3 1 UNL1111111111 -0.1252 25 C 4.3850 -0.5570 2.3496 C.ar 1 UNL1111111111 -0.1360 26 C 5.9114 0.7090 0.9723 C.ar 1 UNL1111111111 -0.1383 27 C 5.5125 0.2536 2.2278 C.ar 1 UNL1111111111 -0.1425 28 C -4.8581 -0.6063 0.2535 C.2 1 UNL1111111111 0.5883 29 C -5.4505 1.5269 1.0622 C.3 1 UNL1111111111 -0.1686 30 H 3.6063 -0.2414 -2.1620 H 1 UNL1111111111 0.1640 31 H 3.4347 -1.8972 -1.5163 H 1 UNL1111111111 0.1644 32 H 1.4622 2.7666 -0.7393 H 1 UNL1111111111 0.1982 33 H 2.9843 1.9008 -0.9419 H 1 UNL1111111111 0.1597 34 H 1.9941 -3.4432 -0.7593 H 1 UNL1111111111 0.1601 35 H -2.1568 -3.6701 0.3340 H 1 UNL1111111111 0.1619 36 H 0.8785 2.3402 -3.1795 H 1 UNL1111111111 0.1621 37 H 2.4083 3.2125 -3.0191 H 1 UNL1111111111 0.1473 38 H 2.4069 1.4842 -3.4086 H 1 UNL1111111111 0.1379 39 H -0.0096 -4.7537 -0.0975 H 1 UNL1111111111 0.1464 40 H 2.7693 -1.5396 1.3148 H 1 UNL1111111111 0.1648 41 H 5.4961 0.7234 -1.1386 H 1 UNL1111111111 0.1510 42 H -3.7717 -2.1896 1.2798 H 1 UNL1111111111 0.1609 43 H -3.9043 -2.3838 -0.5258 H 1 UNL1111111111 0.1720 44 H 4.0708 -0.9112 3.3300 H 1 UNL1111111111 0.1536 45 H 6.7917 1.3417 0.8775 H 1 UNL1111111111 0.1500 46 H 6.0799 0.5331 3.1133 H 1 UNL1111111111 0.1504 47 H -2.6207 1.1796 1.4785 H 1 UNL1111111111 0.3275 48 H -1.9715 2.3542 2.5437 H 1 UNL1111111111 0.3074 49 H -6.4863 1.2166 1.2340 H 1 UNL1111111111 0.1425 50 H -5.3535 2.0237 0.0890 H 1 UNL1111111111 0.1522 51 H -5.0829 2.1641 1.8744 H 1 UNL1111111111 0.1466 @BOND 1 1 14 1 2 1 24 1 3 2 17 2 4 3 23 2 5 4 28 1 6 4 29 1 7 5 28 2 8 6 8 ar 9 6 9 ar 10 6 12 1 11 7 23 am 12 7 47 1 13 7 48 1 14 8 11 ar 15 8 13 1 16 9 10 ar 17 9 15 ar 18 10 11 ar 19 10 14 ar 20 11 17 1 21 12 16 1 22 12 30 1 23 12 31 1 24 13 19 1 25 13 32 1 26 13 33 1 27 14 18 ar 28 15 20 ar 29 15 34 1 30 16 21 ar 31 16 22 ar 32 17 23 1 33 18 20 ar 34 18 35 1 35 19 36 1 36 19 37 1 37 19 38 1 38 20 39 1 39 21 25 ar 40 21 40 1 41 22 26 ar 42 22 41 1 43 24 28 1 44 24 42 1 45 24 43 1 46 25 27 ar 47 25 44 1 48 26 27 ar 49 26 45 1 50 27 46 1 51 29 49 1 52 29 50 1 53 29 51 1