@MOLECULE N,N-dimethyl-4-[(E)-phenylazo]benzeneamine oxide 33 34 0 0 0 SMALL USER_CHARGES @ATOM 1 O 4.9201 1.2245 0.1716 O.3 1 UNL11111111 -0.7306 2 N 4.4623 0.0048 0.0909 N.4 1 UNL11111111 0.3957 3 N -1.1874 0.1895 -0.5072 N.2 1 UNL11111111 -0.1416 4 N -1.9590 -0.1755 0.3990 N.2 1 UNL11111111 -0.1419 5 C 2.9738 0.0063 -0.0342 C.ar 1 UNL11111111 -0.0155 6 C 4.8461 -0.7523 1.3448 C.3 1 UNL11111111 -0.3703 7 C 5.0617 -0.6696 -1.1242 C.3 1 UNL11111111 -0.3703 8 C 2.2599 -1.1886 -0.1301 C.ar 1 UNL11111111 -0.1661 9 C 2.3233 1.2412 -0.0434 C.ar 1 UNL11111111 -0.0896 10 C 0.8724 -1.1474 -0.2311 C.ar 1 UNL11111111 -0.1667 11 C 0.9389 1.2884 -0.1534 C.ar 1 UNL11111111 -0.1654 12 C 0.2214 0.0899 -0.2477 C.ar 1 UNL11111111 0.1061 13 C -3.3671 -0.0678 0.1508 C.ar 1 UNL11111111 0.0929 14 C -4.0968 -1.2613 0.0928 C.ar 1 UNL11111111 -0.1618 15 C -4.0072 1.1746 0.1141 C.ar 1 UNL11111111 -0.1652 16 C -5.4839 -1.1994 0.0051 C.ar 1 UNL11111111 -0.1293 17 C -5.3974 1.2166 0.0377 C.ar 1 UNL11111111 -0.1275 18 C -6.1343 0.0346 -0.0165 C.ar 1 UNL11111111 -0.1555 19 H 4.3422 -0.2935 2.2122 H 1 UNL11111111 0.1763 20 H 4.5876 -1.8129 1.2838 H 1 UNL11111111 0.1437 21 H 5.9299 -0.6365 1.5143 H 1 UNL11111111 0.1767 22 H 6.1601 -0.6001 -1.0678 H 1 UNL11111111 0.1753 23 H 4.7568 -1.7158 -1.2108 H 1 UNL11111111 0.1438 24 H 4.7596 -0.1155 -2.0293 H 1 UNL11111111 0.1774 25 H 2.7667 -2.1538 -0.1224 H 1 UNL11111111 0.1572 26 H 2.9215 2.1622 0.0378 H 1 UNL11111111 0.2114 27 H 0.2967 -2.0695 -0.2958 H 1 UNL11111111 0.1688 28 H 0.4169 2.2454 -0.1672 H 1 UNL11111111 0.1764 29 H -3.5824 -2.2202 0.1192 H 1 UNL11111111 0.1654 30 H -3.4247 2.0935 0.1473 H 1 UNL11111111 0.1671 31 H -6.0647 -2.1209 -0.0450 H 1 UNL11111111 0.1544 32 H -5.9092 2.1780 0.0181 H 1 UNL11111111 0.1551 33 H -7.2202 0.0741 -0.0765 H 1 UNL11111111 0.1537 @BOND 1 24 7 1 2 23 7 1 3 7 22 1 4 7 2 1 5 3 12 1 6 3 4 2 7 27 10 1 8 12 10 ar 9 12 11 ar 10 10 8 ar 11 28 11 1 12 11 9 ar 13 8 25 1 14 8 5 ar 15 33 18 1 16 31 16 1 17 9 5 ar 18 9 26 1 19 5 2 1 20 18 16 ar 21 18 17 ar 22 16 14 ar 23 32 17 1 24 17 15 ar 25 2 1 1 26 2 6 1 27 14 29 1 28 14 13 ar 29 15 30 1 30 15 13 ar 31 13 4 1 32 20 6 1 33 6 21 1 34 6 19 1