@MOLECULE dibenzepin 43 45 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5121 -2.3656 0.7064 O.2 1 UNL1111111111 -0.5197 2 N -0.6883 -0.1659 0.3344 N.ar 1 UNL1111111111 -0.4791 3 N 1.9398 0.6756 1.0585 N.ar 1 UNL1111111111 -0.4023 4 N -4.3905 -0.5820 0.2670 N.3 1 UNL1111111111 -0.3916 5 C -2.0629 -0.2337 0.8705 C.3 1 UNL1111111111 -0.0537 6 C -0.2004 1.1045 -0.0432 C.ar 1 UNL1111111111 0.1739 7 C 1.0965 1.5543 0.3051 C.ar 1 UNL1111111111 0.1041 8 C -3.0097 -0.8888 -0.1701 C.3 1 UNL1111111111 -0.1468 9 C 2.4046 -0.4173 0.2668 C.ar 1 UNL1111111111 0.2257 10 C 1.4538 -1.3747 -0.1197 C.ar 1 UNL1111111111 -0.1939 11 C 0.0501 -1.3453 0.3520 C.ar 1 UNL1111111111 0.6100 12 C -1.0416 1.9592 -0.7719 C.ar 1 UNL1111111111 -0.1977 13 C 1.5054 2.8386 -0.0659 C.ar 1 UNL1111111111 -0.1905 14 C 2.9372 1.3242 1.9223 C.3 1 UNL1111111111 -0.2515 15 C 3.7483 -0.5887 -0.0925 C.ar 1 UNL1111111111 -0.2594 16 C 1.8446 -2.4762 -0.8814 C.ar 1 UNL1111111111 -0.0442 17 C -0.6221 3.2369 -1.1247 C.ar 1 UNL1111111111 -0.1323 18 C 0.6476 3.6804 -0.7673 C.ar 1 UNL1111111111 -0.1530 19 C 4.1231 -1.6921 -0.8528 C.ar 1 UNL1111111111 -0.0709 20 C 3.1755 -2.6304 -1.2588 C.ar 1 UNL1111111111 -0.2092 21 C -5.2902 -1.7346 0.0585 C.3 1 UNL1111111111 -0.2782 22 C -4.9140 0.6191 -0.4175 C.3 1 UNL1111111111 -0.2811 23 H -2.0635 -0.8435 1.8062 H 1 UNL1111111111 0.1704 24 H -2.4183 0.7777 1.1571 H 1 UNL1111111111 0.1497 25 H -2.7778 -0.5349 -1.1936 H 1 UNL1111111111 0.1255 26 H -2.8238 -1.9866 -0.1749 H 1 UNL1111111111 0.1619 27 H -2.0330 1.6165 -1.0679 H 1 UNL1111111111 0.1677 28 H 2.5038 3.1894 0.1886 H 1 UNL1111111111 0.1584 29 H 3.7425 1.8507 1.3877 H 1 UNL1111111111 0.1267 30 H 3.3899 0.5533 2.5739 H 1 UNL1111111111 0.1613 31 H 2.4181 2.0457 2.5802 H 1 UNL1111111111 0.1604 32 H 4.4973 0.1387 0.2066 H 1 UNL1111111111 0.1616 33 H 1.0979 -3.2246 -1.1630 H 1 UNL1111111111 0.1725 34 H -1.2892 3.8886 -1.6866 H 1 UNL1111111111 0.1531 35 H 0.9755 4.6805 -1.0420 H 1 UNL1111111111 0.1518 36 H 5.1680 -1.8201 -1.1359 H 1 UNL1111111111 0.1480 37 H 3.4758 -3.4861 -1.8587 H 1 UNL1111111111 0.1584 38 H -6.2918 -1.4843 0.4449 H 1 UNL1111111111 0.1427 39 H -4.9192 -2.5876 0.6534 H 1 UNL1111111111 0.1517 40 H -5.3903 -2.0541 -0.9887 H 1 UNL1111111111 0.1168 41 H -4.2507 1.4736 -0.2057 H 1 UNL1111111111 0.1428 42 H -5.9030 0.8668 0.0025 H 1 UNL1111111111 0.1434 43 H -5.0174 0.5157 -1.5075 H 1 UNL1111111111 0.1166 @BOND 1 1 11 2 2 2 5 1 3 2 6 ar 4 2 11 ar 5 3 7 ar 6 3 9 ar 7 3 14 1 8 4 8 1 9 4 21 1 10 4 22 1 11 5 8 1 12 5 23 1 13 5 24 1 14 6 7 ar 15 6 12 ar 16 7 13 ar 17 8 25 1 18 8 26 1 19 9 10 ar 20 9 15 ar 21 10 11 ar 22 10 16 ar 23 12 17 ar 24 12 27 1 25 13 18 ar 26 13 28 1 27 14 29 1 28 14 30 1 29 14 31 1 30 15 19 ar 31 15 32 1 32 16 20 ar 33 16 33 1 34 17 18 ar 35 17 34 1 36 18 35 1 37 19 20 ar 38 19 36 1 39 20 37 1 40 21 38 1 41 21 39 1 42 21 40 1 43 22 41 1 44 22 42 1 45 22 43 1