@MOLECULE butenafine 51 53 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.7415 -1.2781 0.3085 N.3 1 UNL111111111111111 -0.3980 2 C 5.3640 0.7976 -0.4105 C.3 1 UNL111111111111111 0.1104 3 C 4.0910 0.0651 -0.0350 C.ar 1 UNL111111111111111 -0.0132 4 C 5.7507 1.7421 0.7431 C.3 1 UNL111111111111111 -0.4593 5 C 5.1078 1.6094 -1.6944 C.3 1 UNL111111111111111 -0.4583 6 C 6.5462 -0.1515 -0.6716 C.3 1 UNL111111111111111 -0.4628 7 C 0.4021 -1.9084 1.0208 C.3 1 UNL111111111111111 -0.1266 8 C 1.6860 -1.2174 0.6423 C.ar 1 UNL111111111111111 -0.0182 9 C 2.9296 0.8075 0.2168 C.ar 1 UNL111111111111111 -0.1768 10 C 4.0297 -1.3245 0.0641 C.ar 1 UNL111111111111111 -0.1725 11 C -2.0252 -1.7625 0.8821 C.3 1 UNL111111111111111 -0.1328 12 C 1.7393 0.1756 0.5539 C.ar 1 UNL111111111111111 -0.1318 13 C 2.8361 -1.9637 0.3983 C.ar 1 UNL111111111111111 -0.1779 14 C -3.1999 -1.0965 0.2090 C.ar 1 UNL111111111111111 0.0042 15 C -3.3695 0.3202 0.2590 C.ar 1 UNL111111111111111 -0.0190 16 C -0.6694 -1.5363 -1.1439 C.3 1 UNL111111111111111 -0.2815 17 C -4.5049 0.8906 -0.3604 C.ar 1 UNL111111111111111 0.0011 18 C -4.1272 -1.8804 -0.4350 C.ar 1 UNL111111111111111 -0.1938 19 C -2.4380 1.1834 0.9016 C.ar 1 UNL111111111111111 -0.1182 20 C -5.4490 0.0541 -1.0178 C.ar 1 UNL111111111111111 -0.1690 21 C -5.2615 -1.3021 -1.0535 C.ar 1 UNL111111111111111 -0.1361 22 C -4.6905 2.3009 -0.3217 C.ar 1 UNL111111111111111 -0.1724 23 C -2.6344 2.5400 0.9241 C.ar 1 UNL111111111111111 -0.1689 24 C -3.7769 3.1065 0.3064 C.ar 1 UNL111111111111111 -0.1360 25 H 6.6877 2.2660 0.5294 H 1 UNL111111111111111 0.1457 26 H 4.9832 2.5017 0.9212 H 1 UNL111111111111111 0.1457 27 H 5.8839 1.1853 1.6772 H 1 UNL111111111111111 0.1487 28 H 4.3356 2.3711 -1.5473 H 1 UNL111111111111111 0.1466 29 H 6.0155 2.1227 -2.0268 H 1 UNL111111111111111 0.1448 30 H 4.7742 0.9576 -2.5097 H 1 UNL111111111111111 0.1500 31 H 6.7909 -0.7431 0.2170 H 1 UNL111111111111111 0.1467 32 H 6.3333 -0.8411 -1.4954 H 1 UNL111111111111111 0.1474 33 H 7.4465 0.4105 -0.9442 H 1 UNL111111111111111 0.1469 34 H 0.4681 -3.0030 0.8352 H 1 UNL111111111111111 0.1214 35 H 0.2433 -1.7805 2.1190 H 1 UNL111111111111111 0.1486 36 H -2.0333 -1.4977 1.9676 H 1 UNL111111111111111 0.1522 37 H -2.1207 -2.8706 0.8295 H 1 UNL111111111111111 0.1243 38 H 2.9531 1.8938 0.1459 H 1 UNL111111111111111 0.1512 39 H 4.9109 -1.9349 -0.1207 H 1 UNL111111111111111 0.1528 40 H 0.8347 0.7595 0.7342 H 1 UNL111111111111111 0.1716 41 H 2.8117 -3.0490 0.4634 H 1 UNL111111111111111 0.1471 42 H -0.7727 -2.5933 -1.4257 H 1 UNL111111111111111 0.1193 43 H 0.2956 -1.1621 -1.5287 H 1 UNL111111111111111 0.1569 44 H -1.4645 -0.9587 -1.6477 H 1 UNL111111111111111 0.1558 45 H -4.0078 -2.9609 -0.4840 H 1 UNL111111111111111 0.1523 46 H -1.5475 0.7460 1.3594 H 1 UNL111111111111111 0.1782 47 H -6.3162 0.5127 -1.4884 H 1 UNL111111111111111 0.1533 48 H -5.9754 -1.9533 -1.5543 H 1 UNL111111111111111 0.1513 49 H -5.5703 2.7231 -0.8006 H 1 UNL111111111111111 0.1505 50 H -1.9175 3.1975 1.4115 H 1 UNL111111111111111 0.1514 51 H -3.9104 4.1857 0.3384 H 1 UNL111111111111111 0.1464 @BOND 1 1 7 1 2 1 11 1 3 1 16 1 4 2 3 1 5 2 4 1 6 2 5 1 7 2 6 1 8 3 9 ar 9 3 10 ar 10 4 25 1 11 4 26 1 12 4 27 1 13 5 28 1 14 5 29 1 15 5 30 1 16 6 31 1 17 6 32 1 18 6 33 1 19 7 8 1 20 7 34 1 21 7 35 1 22 8 12 ar 23 8 13 ar 24 9 12 ar 25 9 38 1 26 10 13 ar 27 10 39 1 28 11 14 1 29 11 36 1 30 11 37 1 31 12 40 1 32 13 41 1 33 14 15 ar 34 14 18 ar 35 15 17 ar 36 15 19 ar 37 16 42 1 38 16 43 1 39 16 44 1 40 17 20 ar 41 17 22 ar 42 18 21 ar 43 18 45 1 44 19 23 ar 45 19 46 1 46 20 21 ar 47 20 47 1 48 21 48 1 49 22 24 ar 50 22 49 1 51 23 24 ar 52 23 50 1 53 24 51 1