@MOLECULE 1-(2-chlorophenyl)-6,8-dimethoxy-3-methylimidazo[5,1-c][1,2,4]benzotriazine 40 43 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 1.7054 4.6591 0.1312 C.3 1 UNL1 -0.4206 2 C 1.3895 3.2243 0.1936 C.ar 1 UNL1 0.1535 3 C 0.1346 2.6045 0.1684 C.ar 1 UNL1 0.0012 4 N -1.1650 3.0850 0.0286 N.ar 1 UNL1 -0.0930 5 N -2.1375 2.3098 -0.0150 N.ar 1 UNL1 -0.0488 6 C -1.9756 0.9164 0.1058 C.ar 1 UNL1 -0.2181 7 C -0.6982 0.3129 0.2886 C.ar 1 UNL1 0.2870 8 N 0.3824 1.1978 0.2746 N.ar 1 UNL1 -0.2778 9 C 1.7743 1.0405 0.3164 C.ar 1 UNL1 0.2239 10 N 2.3687 2.2479 0.2872 N.ar 1 UNL1 -0.3759 11 C 2.4750 -0.2334 0.3221 C.ar 1 UNL1 -0.0623 12 C 3.3019 -0.5773 1.3939 C.ar 1 UNL1 -0.0714 13 C 3.9807 -1.7950 1.3805 C.ar 1 UNL1 -0.1658 14 C 3.8488 -2.6653 0.2994 C.ar 1 UNL1 -0.1043 15 C 3.0399 -2.3267 -0.7860 C.ar 1 UNL1 -0.1741 16 C 2.3694 -1.1129 -0.7567 C.ar 1 UNL1 0.0426 17 CL 1.3687 -0.6846 -2.0697 Cl 1 UNL1 -0.0579 18 C -0.5706 -1.0589 0.4807 C.ar 1 UNL1 -0.4031 19 C -1.7251 -1.8509 0.4000 C.ar 1 UNL1 0.3789 20 C -2.9971 -1.3084 0.1869 C.ar 1 UNL1 -0.4797 21 C -3.1170 0.0737 0.0574 C.ar 1 UNL1 0.3668 22 O -4.2674 0.7450 -0.1207 O.3 1 UNL1 -0.2193 23 C -5.4700 -0.0189 -0.1585 C.3 1 UNL1 -0.2249 24 O -1.4560 -3.1645 0.5559 O.3 1 UNL1 -0.2807 25 C -2.5371 -4.0800 0.4193 C.3 1 UNL1 -0.2047 26 H 2.0056 5.0452 1.1201 H 1 UNL1 0.1699 27 H 2.5456 4.8586 -0.5557 H 1 UNL1 0.1751 28 H 0.8406 5.2526 -0.2085 H 1 UNL1 0.1733 29 H 3.4154 0.1144 2.2312 H 1 UNL1 0.1732 30 H 4.6201 -2.0646 2.2196 H 1 UNL1 0.1577 31 H 4.3813 -3.6155 0.2979 H 1 UNL1 0.1519 32 H 2.9412 -3.0029 -1.6343 H 1 UNL1 0.1726 33 H 0.3841 -1.5333 0.6928 H 1 UNL1 0.2039 34 H -3.8672 -1.9479 0.1282 H 1 UNL1 0.1819 35 H -5.4717 -0.7105 -1.0055 H 1 UNL1 0.1381 36 H -5.6377 -0.5375 0.7898 H 1 UNL1 0.1382 37 H -6.2253 0.7677 -0.3040 H 1 UNL1 0.1628 38 H -3.2827 -3.9244 1.2044 H 1 UNL1 0.1365 39 H -2.9801 -4.0158 -0.5795 H 1 UNL1 0.1388 40 H -2.0338 -5.0477 0.5533 H 1 UNL1 0.1546 @BOND 1 17 16 1 2 32 15 1 3 35 23 1 4 15 16 ar 5 15 14 ar 6 16 11 ar 7 39 25 1 8 27 1 1 9 37 23 1 10 28 1 1 11 23 22 1 12 23 36 1 13 22 21 1 14 5 4 ar 15 5 6 ar 16 4 3 ar 17 21 6 ar 18 21 20 ar 19 6 7 ar 20 34 20 1 21 1 2 1 22 1 26 1 23 3 2 ar 24 3 8 ar 25 20 19 ar 26 2 10 ar 27 8 7 ar 28 8 9 ar 29 10 9 ar 30 7 18 ar 31 31 14 1 32 14 13 ar 33 9 11 1 34 11 12 ar 35 19 18 ar 36 19 24 1 37 25 40 1 38 25 24 1 39 25 38 1 40 18 33 1 41 13 12 ar 42 13 30 1 43 12 29 1