@MOLECULE (z)-2-diazonio-1-methoxy-2-phenylethenolate 21 21 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.7403 0.0911 -0.1845 O.3 1 UNL1 -0.4451 2 O 1.2718 1.8005 -0.1166 O.2 1 UNL1 -0.4738 3 N 0.9263 -1.6827 0.3542 N.3 1 UNL1 0.3683 4 N 1.2677 -2.7401 0.5590 N.3 1 UNL1 -0.0971 5 C -0.9062 -0.1484 0.0508 C.ar 1 UNL1 0.0451 6 C -1.7565 -0.9230 -0.7447 C.ar 1 UNL1 -0.1712 7 C -1.4120 0.9466 0.7577 C.ar 1 UNL1 -0.1283 8 C 0.5219 -0.4610 0.1325 C.3 1 UNL1 -0.3691 9 C -3.1097 -0.6046 -0.8235 C.ar 1 UNL1 -0.1384 10 C -2.7660 1.2597 0.6714 C.ar 1 UNL1 -0.1365 11 C -3.6158 0.4846 -0.1161 C.ar 1 UNL1 -0.1458 12 C 1.4843 0.6190 -0.0631 C.2 1 UNL1 0.6441 13 C 3.7883 1.0328 -0.3882 C.3 1 UNL1 -0.1537 14 H -1.3645 -1.7623 -1.3134 H 1 UNL1 0.1507 15 H -0.7427 1.5629 1.3597 H 1 UNL1 0.1711 16 H -3.7723 -1.2044 -1.4448 H 1 UNL1 0.1497 17 H -3.1586 2.1150 1.2186 H 1 UNL1 0.1525 18 H -4.6729 0.7323 -0.1828 H 1 UNL1 0.1486 19 H 3.5781 1.6557 -1.2650 H 1 UNL1 0.1446 20 H 4.6636 0.3941 -0.5528 H 1 UNL1 0.1451 21 H 3.9058 1.6553 0.5051 H 1 UNL1 0.1394 @BOND 1 16 9 1 2 14 6 1 3 19 13 1 4 9 6 ar 5 9 11 ar 6 6 5 ar 7 20 13 1 8 13 1 1 9 13 21 1 10 1 12 1 11 18 11 1 12 2 12 2 13 11 10 ar 14 12 8 1 15 5 8 1 16 5 7 ar 17 8 3 1 18 3 4 1 19 10 7 ar 20 10 17 1 21 7 15 1