@MOLECULE naminidil 39 39 0 0 0 SMALL GASTEIGER @ATOM 1 N -1.4075 -0.0370 0.4099 N.pl3 1 UNL1111111111 -0.5166 2 N 0.2034 1.6926 0.3874 N.pl3 1 UNL1111111111 -0.5204 3 N -2.0676 2.2948 0.2470 N.pl3 1 UNL1111111111 -0.5469 4 N -1.6109 4.2576 -1.2596 N.1 1 UNL1111111111 -0.2488 5 N 6.0307 -1.6848 -0.2808 N.1 1 UNL1111111111 -0.2541 6 C -2.6015 -2.0473 -0.3143 C.3 1 UNL1111111111 0.1277 7 C -2.7447 -0.6053 0.2921 C.3 1 UNL1111111111 0.0728 8 C -2.0272 -1.9218 -1.7356 C.3 1 UNL1111111111 -0.4642 9 C -1.6849 -2.9273 0.5397 C.3 1 UNL1111111111 -0.4554 10 C -3.9967 -2.6861 -0.4064 C.3 1 UNL1111111111 -0.4743 11 C -3.3941 -0.6016 1.6863 C.3 1 UNL1111111111 -0.4672 12 C -1.1112 1.2053 0.3264 C.cat 1 UNL1111111111 0.5357 13 C 1.3669 0.9141 0.2701 C.ar 1 UNL1111111111 0.2879 14 C 2.5732 1.5378 0.6575 C.ar 1 UNL1111111111 -0.2751 15 C 1.3890 -0.3857 -0.2578 C.ar 1 UNL1111111111 -0.2435 16 C 3.7749 0.8628 0.5127 C.ar 1 UNL1111111111 -0.0377 17 C 2.5974 -1.0527 -0.3974 C.ar 1 UNL1111111111 -0.0397 18 C 3.7940 -0.4347 -0.0138 C.ar 1 UNL1111111111 -0.1134 19 C -1.8281 3.3303 -0.5961 C.1 1 UNL1111111111 0.2337 20 C 5.0255 -1.1227 -0.1604 C.1 1 UNL1111111111 0.1224 21 H -3.3892 -0.0175 -0.4139 H 1 UNL1111111111 0.1132 22 H -2.6677 -1.3138 -2.3809 H 1 UNL1111111111 0.1406 23 H -1.0313 -1.4630 -1.7262 H 1 UNL1111111111 0.1552 24 H -1.9251 -2.9048 -2.2080 H 1 UNL1111111111 0.1487 25 H -1.5021 -3.8950 0.0627 H 1 UNL1111111111 0.1429 26 H -0.7107 -2.4433 0.6999 H 1 UNL1111111111 0.1678 27 H -2.1111 -3.1198 1.5291 H 1 UNL1111111111 0.1423 28 H -4.7014 -2.0521 -0.9525 H 1 UNL1111111111 0.1430 29 H -4.4191 -2.8889 0.5826 H 1 UNL1111111111 0.1467 30 H -3.9482 -3.6469 -0.9326 H 1 UNL1111111111 0.1517 31 H -4.4105 -1.0068 1.6551 H 1 UNL1111111111 0.1553 32 H -2.8120 -1.2132 2.3904 H 1 UNL1111111111 0.1708 33 H -3.4456 0.4049 2.1123 H 1 UNL1111111111 0.1423 34 H 0.3163 2.6409 0.7491 H 1 UNL1111111111 0.3320 35 H -3.0483 2.0550 0.4084 H 1 UNL1111111111 0.3352 36 H 2.5665 2.5449 1.0685 H 1 UNL1111111111 0.1665 37 H 0.4634 -0.8849 -0.5536 H 1 UNL1111111111 0.1991 38 H 4.7098 1.3420 0.8100 H 1 UNL1111111111 0.1609 39 H 2.6147 -2.0646 -0.8075 H 1 UNL1111111111 0.1627 @BOND 1 1 7 1 2 1 12 2 3 2 12 1 4 2 13 1 5 2 34 1 6 3 12 1 7 3 19 1 8 3 35 1 9 4 19 3 10 5 20 3 11 6 7 1 12 6 8 1 13 6 9 1 14 6 10 1 15 7 11 1 16 7 21 1 17 8 22 1 18 8 23 1 19 8 24 1 20 9 25 1 21 9 26 1 22 9 27 1 23 10 28 1 24 10 29 1 25 10 30 1 26 11 31 1 27 11 32 1 28 11 33 1 29 13 14 ar 30 13 15 ar 31 14 16 ar 32 14 36 1 33 15 17 ar 34 15 37 1 35 16 18 ar 36 16 38 1 37 17 18 ar 38 17 39 1 39 18 20 1