@MOLECULE (1z,4z)-3-benzyl-1,5-bis(diazonio)-1,4-pentadiene-2,4-diolate 28 28 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -2.3859 -1.3331 -1.5863 O.2 1 UNL1 -0.4776 2 O -0.5521 1.2658 1.2074 O.2 1 UNL1 -0.4995 3 N -4.0592 -0.8950 0.5759 N.3 1 UNL1 0.3902 4 N 0.0350 3.2721 -0.5738 N.3 1 UNL1 0.3929 5 N -5.1593 -1.1533 0.5631 N.3 1 UNL1 -0.1215 6 N 0.1386 4.3471 -0.2433 N.3 1 UNL1 -0.1121 7 C -0.4971 -0.4189 -0.4801 C.3 1 UNL1 -0.2951 8 C 0.2571 -1.3725 0.4630 C.3 1 UNL1 -0.2625 9 C 1.7346 -1.1581 0.3193 C.ar 1 UNL1 0.0053 10 C -1.9586 -0.8305 -0.5717 C.2 1 UNL1 0.5231 11 C -0.3893 1.0029 0.0357 C.2 1 UNL1 0.5321 12 C 2.4558 -1.8786 -0.6345 C.ar 1 UNL1 -0.1709 13 C 2.3878 -0.2220 1.1235 C.ar 1 UNL1 -0.1704 14 C 3.8240 -1.6625 -0.7827 C.ar 1 UNL1 -0.1425 15 C 3.7543 -0.0034 0.9682 C.ar 1 UNL1 -0.1423 16 C 4.4742 -0.7233 0.0158 C.ar 1 UNL1 -0.1577 17 C -2.7959 -0.5985 0.5915 C.3 1 UNL1 -0.5327 18 C -0.0884 2.0325 -0.9447 C.3 1 UNL1 -0.5272 19 H -0.0490 -0.5032 -1.5066 H 1 UNL1 0.1942 20 H -0.0672 -1.2076 1.5145 H 1 UNL1 0.1729 21 H -0.0128 -2.4246 0.2327 H 1 UNL1 0.1616 22 H 1.9502 -2.6081 -1.2640 H 1 UNL1 0.1542 23 H 1.8255 0.3406 1.8699 H 1 UNL1 0.1658 24 H 4.3858 -2.2279 -1.5233 H 1 UNL1 0.1477 25 H 4.2611 0.7295 1.5932 H 1 UNL1 0.1497 26 H 5.5420 -0.5530 -0.1023 H 1 UNL1 0.1494 27 H -2.3493 -0.1504 1.4877 H 1 UNL1 0.2471 28 H 0.0406 1.7609 -1.9917 H 1 UNL1 0.2258 @BOND 1 28 18 1 2 1 10 2 3 24 14 1 4 19 7 1 5 22 12 1 6 18 4 1 7 18 11 1 8 14 12 ar 9 14 16 ar 10 12 9 ar 11 4 6 1 12 10 7 1 13 10 17 1 14 7 11 1 15 7 8 1 16 26 16 1 17 16 15 ar 18 11 2 2 19 21 8 1 20 9 8 1 21 9 13 ar 22 8 20 1 23 5 3 1 24 3 17 1 25 17 27 1 26 15 13 ar 27 15 25 1 28 13 23 1