@MOLECULE 1,3-dichloro-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline 31 33 0 0 0 SMALL GASTEIGER @ATOM 1 CL 1.7049 2.9357 0.1176 Cl 1 UNL11111111 -0.0797 2 CL 4.3223 -1.6981 0.2143 Cl 1 UNL11111111 -0.0736 3 N -1.9563 0.4523 -0.6401 N.pl3 1 UNL11111111 -0.4667 4 N -0.7056 -1.5528 -0.3598 N.2 1 UNL11111111 -0.5529 5 C -3.2665 1.1153 -0.5933 C.3 1 UNL11111111 -0.0653 6 C -3.9971 0.9018 0.7447 C.3 1 UNL11111111 -0.3048 7 C -4.7943 -0.4062 0.7596 C.3 1 UNL11111111 -0.2693 8 C -3.8971 -1.6481 0.7248 C.3 1 UNL11111111 -0.2596 9 C -3.0933 -1.7664 -0.5761 C.3 1 UNL11111111 -0.2896 10 C -1.8498 -0.9158 -0.4956 C.2 1 UNL11111111 0.4469 11 C -0.8109 1.3278 -0.3083 C.3 1 UNL11111111 -0.0541 12 C 0.4791 0.5769 -0.1599 C.ar 1 UNL11111111 -0.1993 13 C 0.4755 -0.8337 -0.2131 C.ar 1 UNL11111111 0.2567 14 C 1.6897 1.2274 0.0291 C.ar 1 UNL11111111 0.0716 15 C 1.6814 -1.5509 -0.0975 C.ar 1 UNL11111111 -0.2212 16 C 2.8971 0.5539 0.1484 C.ar 1 UNL11111111 -0.2486 17 C 2.8520 -0.8364 0.0767 C.ar 1 UNL11111111 0.0791 18 H -3.8826 0.7343 -1.4416 H 1 UNL11111111 0.1501 19 H -3.1275 2.2036 -0.7862 H 1 UNL11111111 0.1451 20 H -4.6806 1.7529 0.9299 H 1 UNL11111111 0.1452 21 H -3.2721 0.9153 1.5818 H 1 UNL11111111 0.1557 22 H -5.5059 -0.4287 -0.0877 H 1 UNL11111111 0.1390 23 H -5.4243 -0.4395 1.6718 H 1 UNL11111111 0.1407 24 H -4.5209 -2.5558 0.8501 H 1 UNL11111111 0.1451 25 H -3.2078 -1.6477 1.5938 H 1 UNL11111111 0.1554 26 H -3.7045 -1.4981 -1.4587 H 1 UNL11111111 0.1609 27 H -2.7909 -2.8295 -0.7358 H 1 UNL11111111 0.1857 28 H -1.0251 1.8982 0.6312 H 1 UNL11111111 0.1487 29 H -0.7222 2.0756 -1.1400 H 1 UNL11111111 0.1642 30 H 1.6566 -2.6416 -0.1479 H 1 UNL11111111 0.2014 31 H 3.8369 1.0871 0.2893 H 1 UNL11111111 0.1931 @BOND 1 1 14 1 2 2 17 1 3 3 5 1 4 3 10 1 5 3 11 1 6 4 10 2 7 4 13 1 8 5 6 1 9 5 18 1 10 5 19 1 11 6 7 1 12 6 20 1 13 6 21 1 14 7 8 1 15 7 22 1 16 7 23 1 17 8 9 1 18 8 24 1 19 8 25 1 20 9 10 1 21 9 26 1 22 9 27 1 23 11 12 1 24 11 28 1 25 11 29 1 26 12 13 ar 27 12 14 ar 28 13 15 ar 29 14 16 ar 30 15 17 ar 31 15 30 1 32 16 17 ar 33 16 31 1