@MOLECULE tiformin 22 21 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.3946 -0.6136 0.7220 O.2 1 UNL1111111111 -0.5349 2 N 1.4471 0.0746 0.1996 N.pl3 1 UNL1111111111 -0.5724 3 N -3.5847 1.2413 -0.5237 N.am 1 UNL1111111111 -0.7158 4 N 3.3009 1.4305 0.6047 N.pl3 1 UNL1111111111 -0.6274 5 N 3.6562 -0.5804 -0.5987 N.pl3 1 UNL1111111111 -0.6758 6 C -0.7017 -1.0387 0.2758 C.3 1 UNL1111111111 -0.2356 7 C -1.4240 0.0698 -0.4950 C.3 1 UNL1111111111 -0.3569 8 C 0.7697 -1.1578 -0.1712 C.3 1 UNL1111111111 -0.0819 9 C -2.8534 0.1701 -0.0288 C.2 1 UNL1111111111 0.6052 10 C 2.7217 0.2509 0.0615 C.cat 1 UNL1111111111 0.5093 11 H -1.2200 -2.0069 0.1373 H 1 UNL1111111111 0.1509 12 H -0.7469 -0.8253 1.3647 H 1 UNL1111111111 0.1665 13 H -0.8843 1.0302 -0.3358 H 1 UNL1111111111 0.1848 14 H -1.3872 -0.1236 -1.5845 H 1 UNL1111111111 0.1617 15 H 0.8189 -1.3260 -1.2707 H 1 UNL1111111111 0.1290 16 H 1.2266 -2.0475 0.3182 H 1 UNL1111111111 0.1212 17 H -4.5366 1.3640 -0.2457 H 1 UNL1111111111 0.3088 18 H -3.1980 1.9314 -1.1229 H 1 UNL1111111111 0.2994 19 H 2.6253 2.0475 1.0410 H 1 UNL1111111111 0.2985 20 H 3.9183 1.9318 -0.0128 H 1 UNL1111111111 0.2819 21 H 4.6254 -0.4680 -0.3550 H 1 UNL1111111111 0.2942 22 H 3.3967 -1.5432 -0.7108 H 1 UNL1111111111 0.2893 @BOND 1 1 9 2 2 2 8 1 3 2 10 2 4 3 9 am 5 3 17 1 6 3 18 1 7 4 10 1 8 4 19 1 9 4 20 1 10 5 10 1 11 5 21 1 12 5 22 1 13 6 7 1 14 6 8 1 15 6 11 1 16 6 12 1 17 7 9 1 18 7 13 1 19 7 14 1 20 8 15 1 21 8 16 1