@MOLECULE 3-(1h-imidazol-1-yl)-5,8-dimethyl-5h-[1,2,4]triazino[5,6-b]indole 32 35 0 0 0 SMALL GASTEIGER @ATOM 1 N 1.0363 -1.6167 -0.0003 N.ar 1 UNL1111 -0.2718 2 N -1.3035 -0.8766 -0.0015 N.ar 1 UNL1111 -0.4795 3 N -0.1910 1.7355 0.0013 N.ar 1 UNL1111 0.0104 4 N -3.4030 0.1985 -0.0008 N.ar 1 UNL1111 -0.2868 5 N -1.4658 1.5664 -0.0001 N.ar 1 UNL1111 -0.2795 6 N -5.5569 0.8155 -0.0002 N.ar 1 UNL1111 -0.3654 7 C 2.2760 -0.9351 0.0011 C.ar 1 UNL1111 0.1110 8 C 2.0459 0.4801 0.0029 C.ar 1 UNL1111 -0.0370 9 C 0.0347 -0.6810 -0.0006 C.ar 1 UNL1111 0.3042 10 C 0.6167 0.6631 0.0016 C.ar 1 UNL1111 -0.1169 11 C 3.1194 1.3590 0.0055 C.ar 1 UNL1111 -0.1191 12 C 3.5648 -1.4596 0.0009 C.ar 1 UNL1111 -0.1904 13 C 4.4112 0.8324 0.0053 C.ar 1 UNL1111 0.0238 14 C 0.8616 -3.0556 -0.0016 C.3 1 UNL1111 -0.2270 15 C 4.6220 -0.5574 0.0018 C.ar 1 UNL1111 -0.1348 16 C -2.0153 0.2834 -0.0011 C.ar 1 UNL1111 0.4244 17 C 5.5848 1.7515 -0.0084 C.3 1 UNL1111 -0.4489 18 C -4.1659 -0.9896 -0.0002 C.ar 1 UNL1111 -0.0819 19 C -4.3185 1.2858 -0.0007 C.ar 1 UNL1111 0.1535 20 C -5.4879 -0.5860 0.0002 C.ar 1 UNL1111 -0.0662 21 H 2.9427 2.4352 0.0073 H 1 UNL1111 0.1795 22 H 3.7396 -2.5310 -0.0000 H 1 UNL1111 0.1649 23 H 1.3289 -3.5056 0.8950 H 1 UNL1111 0.1601 24 H -0.2178 -3.3168 0.0061 H 1 UNL1111 0.1858 25 H 1.3155 -3.5028 -0.9066 H 1 UNL1111 0.1601 26 H 5.6437 -0.9376 -0.0002 H 1 UNL1111 0.1563 27 H 5.3692 2.7117 0.4820 H 1 UNL1111 0.1610 28 H 6.4591 1.3243 0.5014 H 1 UNL1111 0.1545 29 H 5.8913 1.9790 -1.0416 H 1 UNL1111 0.1630 30 H -3.7045 -1.9583 0.0001 H 1 UNL1111 0.1954 31 H -3.9934 2.3176 -0.0010 H 1 UNL1111 0.2145 32 H -6.3892 -1.1681 0.0006 H 1 UNL1111 0.1830 @BOND 1 1 7 ar 2 1 9 ar 3 1 14 1 4 2 9 ar 5 2 16 ar 6 3 5 ar 7 3 10 ar 8 4 16 1 9 4 18 ar 10 4 19 ar 11 5 16 ar 12 6 19 ar 13 6 20 ar 14 7 8 ar 15 7 12 ar 16 8 10 ar 17 8 11 ar 18 9 10 ar 19 11 13 ar 20 11 21 1 21 12 15 ar 22 12 22 1 23 13 15 ar 24 13 17 1 25 14 23 1 26 14 24 1 27 14 25 1 28 15 26 1 29 17 27 1 30 17 28 1 31 17 29 1 32 18 20 ar 33 18 30 1 34 19 31 1 35 20 32 1