@MOLECULE ly-156,735 36 37 0 0 0 SMALL GASTEIGER @ATOM 1 CL -4.1761 0.1848 0.3389 Cl 1 UNL1111111111 -0.0469 2 O -2.4039 -1.6347 -0.8091 O.3 1 UNL1111111111 -0.2849 3 O 2.7653 -2.7521 0.0110 O.2 1 UNL1111111111 -0.5472 4 N 0.1734 3.0009 0.6283 N.ar 1 UNL1111111111 -0.3597 5 N 2.3860 -0.8301 1.1518 N.am 1 UNL1111111111 -0.5961 6 C 2.7078 0.6876 -0.8127 C.3 1 UNL1111111111 -0.0998 7 C 1.5282 1.4407 -0.3273 C.ar 1 UNL1111111111 -0.1301 8 C 0.1911 0.9148 -0.3012 C.ar 1 UNL1111111111 -0.0316 9 C 3.3717 -0.0801 0.3690 C.3 1 UNL1111111111 -0.0738 10 C -0.6361 1.9112 0.3074 C.ar 1 UNL1111111111 0.0437 11 C 1.4793 2.7095 0.2333 C.ar 1 UNL1111111111 -0.0281 12 C 3.7450 1.6002 -1.4711 C.3 1 UNL1111111111 -0.4465 13 C -0.3653 -0.3009 -0.7174 C.ar 1 UNL1111111111 -0.2661 14 C -2.0086 1.7078 0.5162 C.ar 1 UNL1111111111 -0.1700 15 C -1.7156 -0.5026 -0.5031 C.ar 1 UNL1111111111 0.1855 16 C -2.5183 0.4980 0.1078 C.ar 1 UNL1111111111 -0.0453 17 C 2.0889 -2.1413 0.8134 C.2 1 UNL1111111111 0.6070 18 C 0.9271 -2.7502 1.5505 C.3 1 UNL1111111111 -0.5348 19 C -1.7026 -2.6204 -1.5569 C.3 1 UNL1111111111 -0.2054 20 H 2.3714 -0.0722 -1.5684 H 1 UNL1111111111 0.1606 21 H 3.8868 0.6322 1.0490 H 1 UNL1111111111 0.1369 22 H 4.1441 -0.7793 -0.0284 H 1 UNL1111111111 0.1674 23 H 2.2733 3.4174 0.3812 H 1 UNL1111111111 0.1658 24 H 4.5723 1.0190 -1.8952 H 1 UNL1111111111 0.1498 25 H 3.2937 2.1739 -2.2904 H 1 UNL1111111111 0.1538 26 H 4.1712 2.3173 -0.7626 H 1 UNL1111111111 0.1414 27 H -0.1399 3.8514 1.0321 H 1 UNL1111111111 0.3152 28 H 0.2686 -1.0434 -1.1946 H 1 UNL1111111111 0.1815 29 H -2.6278 2.4737 0.9777 H 1 UNL1111111111 0.1779 30 H 1.7098 -0.2644 1.6456 H 1 UNL1111111111 0.3099 31 H 0.8177 -3.8114 1.2787 H 1 UNL1111111111 0.1841 32 H 1.0646 -2.7049 2.6389 H 1 UNL1111111111 0.1760 33 H -0.0192 -2.2452 1.3093 H 1 UNL1111111111 0.1774 34 H -2.4818 -3.3787 -1.7157 H 1 UNL1111111111 0.1543 35 H -0.8736 -3.0381 -0.9763 H 1 UNL1111111111 0.1380 36 H -1.3581 -2.2192 -2.5154 H 1 UNL1111111111 0.1400 @BOND 1 1 16 1 2 2 15 1 3 2 19 1 4 3 17 2 5 4 10 ar 6 4 11 ar 7 4 27 1 8 5 9 1 9 5 17 am 10 5 30 1 11 6 7 1 12 6 9 1 13 6 12 1 14 6 20 1 15 7 8 ar 16 7 11 ar 17 8 10 ar 18 8 13 ar 19 9 21 1 20 9 22 1 21 10 14 ar 22 11 23 1 23 12 24 1 24 12 25 1 25 12 26 1 26 13 15 ar 27 13 28 1 28 14 16 ar 29 14 29 1 30 15 16 ar 31 17 18 1 32 18 31 1 33 18 32 1 34 18 33 1 35 19 34 1 36 19 35 1 37 19 36 1