@MOLECULE FDBF07658 18 17 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.9248 -2.1205 -3.3241 C.3 1 LIG1 -0.0636 2 C 2.4969 -1.0432 -2.3345 C.3 1 LIG1 -0.0376 3 C 3.0752 -1.2604 -0.9279 C.3 1 LIG1 0.0198 4 C 2.5300 -0.2123 0.0437 C.3 1 LIG1 -0.0466 5 N 4.5308 -1.2159 -0.9548 N.am 1 LIG1 -0.3153 6 C 5.3015 -1.9243 -0.0701 C.2 1 LIG1 0.2002 7 O 4.8877 -2.6709 0.8062 O.2 1 LIG1 -0.2795 8 H 2.4608 -1.9402 -4.2991 H 1 LIG1 0.0230 9 H 2.6185 -3.1137 -2.9813 H 1 LIG1 0.0230 10 H 4.0098 -2.1249 -3.4687 H 1 LIG1 0.0230 11 H 1.4015 -1.0371 -2.2812 H 1 LIG1 0.0280 12 H 2.8053 -0.0649 -2.7235 H 1 LIG1 0.0280 13 H 2.7714 -2.2495 -0.5635 H 1 LIG1 0.0495 14 H 2.7780 0.8034 -0.2845 H 1 LIG1 0.0247 15 H 2.9501 -0.3458 1.0464 H 1 LIG1 0.0247 16 H 1.4401 -0.2867 0.1238 H 1 LIG1 0.0247 17 H 4.9908 -0.5498 -1.5622 H 1 LIG1 0.1487 18 H 6.3775 -1.7516 -0.2366 H 1 LIG1 0.1251 @BOND 1 1 2 1 2 3 5 1 3 5 6 am 4 6 7 2 5 3 4 1 6 3 2 1 7 1 8 1 8 1 9 1 9 1 10 1 10 2 11 1 11 2 12 1 12 3 13 1 13 4 14 1 14 4 15 1 15 4 16 1 16 5 17 1 17 6 18 1