@MOLECULE phenazone 26 27 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.4516 2.5389 0.0270 O.2 1 UNL1111111111 -0.3543 2 N -0.3913 0.2357 -0.3104 N.ar 1 UNL1111111111 -0.3896 3 N -1.3069 -0.8330 -0.0102 N.ar 1 UNL1111111111 -0.1945 4 C -2.5761 -0.1960 0.2117 C.ar 1 UNL1111111111 0.6486 5 C 0.9846 -0.0062 -0.0380 C.ar 1 UNL1111111111 0.4722 6 C -1.0406 1.4936 0.0396 C.ar 1 UNL1111111111 0.4681 7 C -2.4369 1.1540 0.3155 C.ar 1 UNL1111111111 -0.7021 8 C -1.2858 -1.8752 -1.0612 C.3 1 UNL1111111111 -0.7021 9 C -3.7791 -1.0299 0.3964 C.3 1 UNL1111111111 -1.0666 10 C 1.8964 1.0069 -0.3837 C.ar 1 UNL1111111111 -0.5163 11 C 1.4457 -1.2328 0.4643 C.ar 1 UNL1111111111 -0.4150 12 C 3.2599 0.7668 -0.2519 C.ar 1 UNL1111111111 -0.0105 13 C 2.8154 -1.4627 0.5565 C.ar 1 UNL1111111111 -0.0232 14 C 3.7243 -0.4700 0.1982 C.ar 1 UNL1111111111 -0.3366 15 H -3.1653 1.8977 0.5630 H 1 UNL1111111111 0.2793 16 H -0.2395 -2.1342 -1.3168 H 1 UNL1111111111 0.2784 17 H -1.7830 -1.5700 -1.9932 H 1 UNL1111111111 0.2490 18 H -1.7726 -2.7788 -0.6545 H 1 UNL1111111111 0.2941 19 H -3.6382 -1.7727 1.2010 H 1 UNL1111111111 0.3399 20 H -4.0441 -1.5929 -0.5140 H 1 UNL1111111111 0.3133 21 H -4.6592 -0.4274 0.6746 H 1 UNL1111111111 0.3133 22 H 1.5426 1.9698 -0.7560 H 1 UNL1111111111 0.2741 23 H 0.7470 -1.9967 0.7976 H 1 UNL1111111111 0.2436 24 H 3.9714 1.5530 -0.5069 H 1 UNL1111111111 0.1541 25 H 3.1757 -2.4252 0.9174 H 1 UNL1111111111 0.1781 26 H 4.7899 -0.6619 0.2822 H 1 UNL1111111111 0.2046 @BOND 1 1 6 2 2 2 3 ar 3 2 5 1 4 2 6 ar 5 3 4 ar 6 3 8 1 7 4 7 ar 8 4 9 1 9 5 10 ar 10 5 11 ar 11 6 7 ar 12 7 15 1 13 8 16 1 14 8 17 1 15 8 18 1 16 9 19 1 17 9 20 1 18 9 21 1 19 10 12 ar 20 10 22 1 21 11 13 ar 22 11 23 1 23 12 14 ar 24 12 24 1 25 13 14 ar 26 13 25 1 27 14 26 1