@MOLECULE 5,6-dimethoxy-1h-azuleno[1,2,3-ij]isoquinoline-9,10-dione 36 39 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.7242 2.3547 -0.2342 O.2 1 UNL1 -0.3062 2 O 4.2548 0.9459 -0.1612 O.2 1 UNL1 -0.2934 3 O -4.7327 -0.2702 -1.1483 O.2 1 UNL1 -0.3969 4 O -4.3670 1.4709 1.2903 O.2 1 UNL1 -0.4190 5 N -0.4481 -3.2065 0.2042 N.pl3 1 UNL1 -0.3041 6 C 0.8307 -1.2110 0.0249 C.3 1 UNL1 -0.2455 7 C 0.6279 0.2147 -0.1278 C.2 1 UNL1 0.1856 8 C -0.3994 -1.8602 0.0624 C.2 1 UNL1 0.2103 9 C -0.7560 0.4510 -0.2109 C.2 1 UNL1 -0.3129 10 C -1.4673 -0.8175 -0.0943 C.2 1 UNL1 0.0913 11 C 2.0873 -1.8536 0.1174 C.2 1 UNL1 0.1464 12 C 1.8030 0.9874 -0.1281 C.2 1 UNL1 -0.0915 13 C 3.2102 -1.0635 0.0455 C.2 1 UNL1 -0.3624 14 C 3.0498 0.3521 -0.0878 C.2 1 UNL1 0.3237 15 C 1.9835 -3.2840 0.2673 C.2 1 UNL1 -0.1972 16 C -1.3364 1.7356 -0.4087 C.2 1 UNL1 0.0410 17 C -2.7750 -1.1095 -0.1561 C.3 1 UNL1 -0.2991 18 C 0.7660 -3.9029 0.3065 C.2 1 UNL1 0.0081 19 C -2.6107 2.1032 -0.1666 C.2 1 UNL1 -0.3999 20 C -3.8093 -0.0913 -0.3969 C.2 1 UNL1 0.3828 21 C -3.6450 1.2262 0.3579 C.2 1 UNL1 0.4206 22 C 1.3873 2.9638 1.0161 C.3 1 UNL1 -0.2180 23 C 4.3248 2.3289 -0.4967 C.3 1 UNL1 -0.1914 24 H -1.3249 -3.7105 0.2317 H 1 UNL1 0.3221 25 H 4.2146 -1.4708 0.0855 H 1 UNL1 0.1853 26 H 2.9044 -3.8614 0.3481 H 1 UNL1 0.1814 27 H -0.6291 2.4984 -0.7795 H 1 UNL1 0.1634 28 H -3.1609 -2.1221 -0.0649 H 1 UNL1 0.1663 29 H 0.6652 -4.9871 0.4210 H 1 UNL1 0.1723 30 H -2.9379 3.1315 -0.3202 H 1 UNL1 0.1793 31 H 1.3153 4.0253 0.7563 H 1 UNL1 0.1440 32 H 2.1732 2.7890 1.7550 H 1 UNL1 0.1251 33 H 0.4263 2.5899 1.3882 H 1 UNL1 0.1473 34 H 5.3966 2.4592 -0.6966 H 1 UNL1 0.1447 35 H 4.0065 2.9411 0.3521 H 1 UNL1 0.1422 36 H 3.7299 2.5551 -1.3893 H 1 UNL1 0.1543 @BOND 1 36 23 1 2 3 20 2 3 27 16 1 4 34 23 1 5 23 2 1 6 23 35 1 7 16 9 1 8 16 19 2 9 20 17 1 10 20 21 1 11 30 19 1 12 1 12 1 13 1 22 1 14 9 7 2 15 9 10 1 16 19 21 1 17 2 14 1 18 17 10 1 19 17 28 1 20 12 7 1 21 12 14 2 22 7 6 1 23 10 8 2 24 14 13 1 25 6 8 1 26 6 11 1 27 13 25 1 28 13 11 2 29 8 5 1 30 11 15 1 31 5 24 1 32 5 18 1 33 15 18 2 34 15 26 1 35 18 29 1 36 21 4 2 37 31 22 1 38 22 33 1 39 22 32 1