@MOLECULE (2e)-2-(1-nitrosoethylidene)-1,2-dihydropyridine 18 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.2373 -0.7258 -0.0098 O.2 1 UNL1 -0.2240 2 N -0.9960 1.1679 -0.0042 N.pl3 1 UNL1 -0.3898 3 N 2.0462 -0.8615 -0.0037 N.2 1 UNL1 0.0427 4 C -0.1278 0.0716 0.0027 C.3 1 UNL1 0.2831 5 C 1.2383 0.2895 0.0037 C.2 1 UNL1 -0.2570 6 C -0.7445 -1.2362 0.0080 C.2 1 UNL1 -0.2260 7 C -2.3685 1.0089 -0.0079 C.2 1 UNL1 0.0616 8 C -2.0950 -1.3839 0.0054 C.2 1 UNL1 -0.0532 9 C -2.9386 -0.2321 -0.0034 C.2 1 UNL1 -0.2831 10 C 1.8433 1.6510 0.0109 C.3 1 UNL1 -0.4310 11 H -0.6018 2.1026 -0.0073 H 1 UNL1 0.3197 12 H -0.0665 -2.0960 0.0149 H 1 UNL1 0.2008 13 H -2.9563 1.9327 -0.0151 H 1 UNL1 0.1636 14 H -2.5594 -2.3706 0.0101 H 1 UNL1 0.1588 15 H -4.0160 -0.3580 -0.0066 H 1 UNL1 0.1700 16 H 1.5842 2.2287 -0.8852 H 1 UNL1 0.1414 17 H 1.5682 2.2262 0.9041 H 1 UNL1 0.1413 18 H 2.9480 1.5870 0.0206 H 1 UNL1 0.1812 @BOND 1 16 10 1 2 13 7 1 3 1 3 1 4 7 2 1 5 7 9 2 6 11 2 1 7 15 9 1 8 2 4 1 9 3 5 2 10 9 8 1 11 4 5 1 12 4 6 1 13 5 10 1 14 8 6 2 15 8 14 1 16 6 12 1 17 10 18 1 18 10 17 1