@MOLECULE bufexamac 33 33 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2698 -0.4084 0.4194 O.3 1 UNL1111111111 -0.3485 2 O 4.2108 -0.9770 0.8472 O.2 1 UNL1111111111 -0.4960 3 O 5.1659 1.4690 1.1470 O.3 1 UNL1111111111 -0.2968 4 N 4.1810 1.1933 0.1903 N.am 1 UNL1111111111 -0.4006 5 C -4.5647 -0.1391 0.3322 C.3 1 UNL1111111111 -0.2935 6 C -5.7318 0.7950 0.0050 C.3 1 UNL1111111111 -0.2465 7 C -3.2481 0.4569 -0.1658 C.3 1 UNL1111111111 -0.0415 8 C 1.6478 -0.4606 -0.8479 C.ar 1 UNL1111111111 -0.0730 9 C -1.0009 -0.3431 -0.0520 C.ar 1 UNL1111111111 0.2624 10 C -7.0454 0.2172 0.5316 C.3 1 UNL1111111111 -0.4374 11 C 3.0932 -0.5041 -1.2334 C.3 1 UNL1111111111 -0.3556 12 C 1.1176 -1.4712 -0.0339 C.ar 1 UNL1111111111 -0.0803 13 C 0.8409 0.5958 -1.2641 C.ar 1 UNL1111111111 -0.0861 14 C -0.2039 -1.4188 0.3715 C.ar 1 UNL1111111111 -0.2456 15 C -0.4948 0.6663 -0.8703 C.ar 1 UNL1111111111 -0.3009 16 C 3.9195 -0.1720 -0.0068 C.2 1 UNL1111111111 0.5522 17 H -4.5069 -0.3230 1.4281 H 1 UNL1111111111 0.1603 18 H -4.7206 -1.1368 -0.1211 H 1 UNL1111111111 0.1527 19 H -5.8012 0.9525 -1.0878 H 1 UNL1111111111 0.1345 20 H -5.5586 1.7919 0.4473 H 1 UNL1111111111 0.1361 21 H -3.1753 0.4311 -1.2658 H 1 UNL1111111111 0.1260 22 H -3.0669 1.4824 0.2014 H 1 UNL1111111111 0.1285 23 H -7.2575 -0.7672 0.0953 H 1 UNL1111111111 0.1450 24 H -7.0213 0.0954 1.6210 H 1 UNL1111111111 0.1457 25 H -7.8917 0.8713 0.2937 H 1 UNL1111111111 0.1416 26 H 3.3144 0.1635 -2.0861 H 1 UNL1111111111 0.1607 27 H 3.3731 -1.5251 -1.5829 H 1 UNL1111111111 0.1871 28 H 1.7620 -2.2927 0.2944 H 1 UNL1111111111 0.1688 29 H 1.2493 1.3821 -1.8974 H 1 UNL1111111111 0.1465 30 H -0.6333 -2.1902 1.0102 H 1 UNL1111111111 0.1751 31 H -1.1095 1.4998 -1.1919 H 1 UNL1111111111 0.1605 32 H 4.3617 1.8351 -0.5626 H 1 UNL1111111111 0.3038 33 H 4.8397 1.0038 1.9846 H 1 UNL1111111111 0.3149 @BOND 1 1 7 1 2 1 9 1 3 2 16 2 4 3 4 1 5 3 33 1 6 4 16 am 7 4 32 1 8 5 6 1 9 5 7 1 10 5 17 1 11 5 18 1 12 6 10 1 13 6 19 1 14 6 20 1 15 7 21 1 16 7 22 1 17 8 11 1 18 8 12 ar 19 8 13 ar 20 9 14 ar 21 9 15 ar 22 10 23 1 23 10 24 1 24 10 25 1 25 11 16 1 26 11 26 1 27 11 27 1 28 12 14 ar 29 12 28 1 30 13 15 ar 31 13 29 1 32 14 30 1 33 15 31 1