@MOLECULE nitromethanal-2-nitrophenylhydrazone 21 21 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 3.1669 0.7782 -0.0238 C.ar 1 UNL1 -0.0299 2 C 0.5697 1.8056 0.0356 C.ar 1 UNL1 -0.2344 3 C 2.9640 2.1449 -0.0248 C.ar 1 UNL1 -0.2189 4 C 1.6587 2.6565 0.0029 C.ar 1 UNL1 -0.0317 5 H -0.1563 -1.4971 0.0848 H 1 UNL1 0.3506 6 C 2.0735 -0.1090 0.0034 C.ar 1 UNL1 -0.2134 7 C 0.7560 0.4075 0.0378 C.ar 1 UNL1 0.2884 8 O 1.4390 -2.3266 0.0144 O.2 1 UNL1 -0.4771 9 O -4.8671 -0.7983 -0.0354 O.2 1 UNL1 -0.3954 10 C -2.5986 -0.7244 0.0355 C.2 1 UNL1 -0.1559 11 N -1.5562 0.0560 0.0286 N.2 1 UNL1 -0.0592 12 O 3.5327 -1.8758 -0.0571 O.2 1 UNL1 -0.3516 13 O -3.9570 1.1562 -0.0513 O.2 1 UNL1 -0.3553 14 N -0.3323 -0.4761 0.0877 N.pl3 1 UNL1 -0.3325 15 N 2.3711 -1.5197 -0.0133 N.pl3 1 UNL1 0.6530 16 N -3.8974 -0.0562 -0.0212 N.pl3 1 UNL1 0.6323 17 H 4.1859 0.3701 -0.0462 H 1 UNL1 0.1867 18 H -0.4483 2.2119 0.0598 H 1 UNL1 0.2061 19 H 3.8128 2.8270 -0.0482 H 1 UNL1 0.1692 20 H 1.5033 3.7386 -0.0013 H 1 UNL1 0.1623 21 H -2.6574 -1.8178 0.0768 H 1 UNL1 0.2067 @BOND 1 12 15 2 2 13 16 2 3 19 3 1 4 17 1 1 5 9 16 2 6 3 1 ar 7 3 4 ar 8 1 6 ar 9 16 10 1 10 15 6 1 11 15 8 2 12 20 4 1 13 4 2 ar 14 6 7 ar 15 11 10 2 16 11 14 1 17 10 21 1 18 2 7 ar 19 2 18 1 20 7 14 1 21 5 14 1