@MOLECULE 2,4-diaminopteridine 18 19 0 0 0 SMALL GASTEIGER @ATOM 1 N 0.8476 -1.4718 0.0012 N.ar 1 UNL1111111111 -0.5471 2 N 1.8809 0.7561 -0.0018 N.ar 1 UNL1111111111 -0.6320 3 N -1.7785 1.1153 -0.0028 N.ar 1 UNL1111111111 -0.2453 4 N -1.4980 -1.7059 0.0024 N.ar 1 UNL1111111111 -0.3351 5 N 0.6118 2.6936 0.0040 N.pl3 1 UNL1111111111 -0.5393 6 N 3.1587 -1.1949 -0.0017 N.pl3 1 UNL1111111111 -0.5520 7 C -0.5482 0.5361 -0.0007 C.ar 1 UNL1111111111 -0.2355 8 C -0.3744 -0.8915 0.0013 C.ar 1 UNL1111111111 0.3808 9 C 0.6622 1.3379 0.0000 C.ar 1 UNL1111111111 0.4870 10 C 1.9217 -0.6250 -0.0003 C.ar 1 UNL1111111111 0.5775 11 C -2.8291 0.3174 -0.0025 C.ar 1 UNL1111111111 -0.1072 12 C -2.6757 -1.1163 0.0008 C.ar 1 UNL1111111111 0.0592 13 H -3.8207 0.7756 -0.0045 H 1 UNL1111111111 0.1889 14 H -3.5592 -1.7704 0.0022 H 1 UNL1111111111 0.1869 15 H 1.4530 3.2382 0.0023 H 1 UNL1111111111 0.3245 16 H -0.2775 3.1609 0.0009 H 1 UNL1111111111 0.3331 17 H 3.9786 -0.6231 -0.0024 H 1 UNL1111111111 0.3247 18 H 3.2475 -2.1937 0.0006 H 1 UNL1111111111 0.3309 @BOND 1 1 8 ar 2 1 10 ar 3 2 9 ar 4 2 10 ar 5 3 7 ar 6 3 11 ar 7 4 8 ar 8 4 12 ar 9 5 9 1 10 5 15 1 11 5 16 1 12 6 10 1 13 6 17 1 14 6 18 1 15 7 8 ar 16 7 9 ar 17 11 12 ar 18 11 13 1 19 12 14 1