@MOLECULE n-acetyl-l-phenylalanylglycinamide 36 36 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.9231 -1.2266 -1.0365 O.2 1 UNL11111111 -0.5307 2 O 0.5328 -2.7183 1.5091 O.2 1 UNL11111111 -0.5319 3 O -3.4694 2.2607 -0.0728 O.2 1 UNL11111111 -0.5258 4 N 0.7585 -1.7607 -0.5307 N.am 1 UNL11111111 -0.5994 5 N -2.0627 0.0620 0.8210 N.am 1 UNL11111111 -0.5611 6 N -5.3716 1.1125 -0.4303 N.am 1 UNL11111111 -0.6899 7 C 0.1776 -0.5100 -0.0555 C.3 1 UNL11111111 0.0242 8 C 0.6690 0.6826 -0.8985 C.3 1 UNL11111111 -0.3172 9 C 2.0246 1.1282 -0.4439 C.ar 1 UNL11111111 0.0179 10 C -1.3575 -0.5847 -0.1787 C.2 1 UNL11111111 0.5463 11 C 2.1358 2.1224 0.5300 C.ar 1 UNL11111111 -0.1688 12 C 3.1736 0.5528 -0.9907 C.ar 1 UNL11111111 -0.1595 13 C 0.8623 -2.8334 0.3480 C.2 1 UNL11111111 0.6165 14 C -3.5193 0.0232 0.8125 C.3 1 UNL11111111 -0.1488 15 C 3.3957 2.5387 0.9550 C.ar 1 UNL11111111 -0.1348 16 C 4.4315 0.9722 -0.5649 C.ar 1 UNL11111111 -0.1406 17 C 4.5427 1.9677 0.4056 C.ar 1 UNL11111111 -0.1604 18 C 1.4457 -4.0929 -0.2226 C.3 1 UNL11111111 -0.5260 19 C -4.0841 1.2232 0.0547 C.2 1 UNL11111111 0.5650 20 H 0.4756 -0.3843 1.0251 H 1 UNL11111111 0.1915 21 H -0.0598 1.5219 -0.8373 H 1 UNL11111111 0.1740 22 H 0.6743 0.4105 -1.9754 H 1 UNL11111111 0.1669 23 H 0.8177 -1.8811 -1.5277 H 1 UNL11111111 0.3163 24 H 1.2432 2.5761 0.9554 H 1 UNL11111111 0.1539 25 H 3.0868 -0.2266 -1.7419 H 1 UNL11111111 0.1495 26 H -1.6356 0.7636 1.4030 H 1 UNL11111111 0.3206 27 H -3.8674 -0.9412 0.3700 H 1 UNL11111111 0.1854 28 H -3.8978 0.0515 1.8649 H 1 UNL11111111 0.1690 29 H 3.4832 3.3123 1.7153 H 1 UNL11111111 0.1477 30 H 5.3271 0.5238 -0.9900 H 1 UNL11111111 0.1466 31 H 5.5255 2.2963 0.7348 H 1 UNL11111111 0.1483 32 H 1.7096 -4.7820 0.5988 H 1 UNL11111111 0.1881 33 H 0.7248 -4.6128 -0.8682 H 1 UNL11111111 0.1774 34 H 2.3574 -3.9088 -0.8034 H 1 UNL11111111 0.1725 35 H -5.8928 0.2659 -0.4253 H 1 UNL11111111 0.3049 36 H -5.7718 1.8823 -0.9299 H 1 UNL11111111 0.3122 @BOND 1 1 10 2 2 2 13 2 3 3 19 2 4 4 7 1 5 4 13 am 6 4 23 1 7 5 10 am 8 5 14 1 9 5 26 1 10 6 19 am 11 6 35 1 12 6 36 1 13 7 8 1 14 7 10 1 15 7 20 1 16 8 9 1 17 8 21 1 18 8 22 1 19 9 11 ar 20 9 12 ar 21 11 15 ar 22 11 24 1 23 12 16 ar 24 12 25 1 25 13 18 1 26 14 19 1 27 14 27 1 28 14 28 1 29 15 17 ar 30 15 29 1 31 16 17 ar 32 16 30 1 33 17 31 1 34 18 32 1 35 18 33 1 36 18 34 1