@MOLECULE 7-amino-15-oxa-2,4,6,9-tetraazatetracyclo[10.2.1.0~2,10~.0~3,8~]pentadeca-3,5,7,9-tetraene-11,13,14-triol 30 33 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.8496 0.1578 -1.4985 O.3 1 UNL1111111111 -0.2778 2 O 3.0771 -0.4694 1.7239 O.3 1 UNL1111111111 -0.3098 3 O 2.9422 2.4895 0.2253 O.3 1 UNL1111111111 -0.3490 4 O 1.3622 -2.8451 -0.8526 O.3 1 UNL1111111111 -0.3522 5 N 0.0127 0.3875 -0.1792 N.ar 1 UNL1111111111 -0.2594 6 N -1.1182 -1.5439 0.2821 N.ar 1 UNL1111111111 -0.3121 7 N -1.9215 1.9322 -0.3351 N.ar 1 UNL1111111111 -0.6522 8 N -4.0344 0.8242 0.0809 N.ar 1 UNL1111111111 -0.7490 9 N -4.2290 -1.4550 0.5731 N.pl3 1 UNL1111111111 -0.9877 10 C 2.4779 -0.7784 -0.6195 C.3 1 UNL1111111111 0.2515 11 C 1.1879 1.1001 -0.6733 C.3 1 UNL1111111111 0.2424 12 C 3.1273 0.1360 0.4593 C.3 1 UNL1111111111 -0.4024 13 C 2.1693 1.3586 0.5200 C.3 1 UNL1111111111 -0.3024 14 C 1.4077 -1.7201 -0.0059 C.3 1 UNL1111111111 -0.5110 15 C 0.0820 -1.0175 0.0535 C.ar 1 UNL1111111111 0.3431 16 C -1.3268 0.7287 -0.1476 C.ar 1 UNL1111111111 0.3325 17 C -2.0256 -0.4890 0.1681 C.ar 1 UNL1111111111 -0.3982 18 C -3.4374 -0.3919 0.2782 C.ar 1 UNL1111111111 0.8345 19 C -3.2669 1.9021 -0.2100 C.ar 1 UNL1111111111 0.3994 20 H 3.1848 -1.3352 -1.2656 H 1 UNL1111111111 0.2085 21 H 0.9380 1.9792 -1.3024 H 1 UNL1111111111 0.1884 22 H 4.1621 0.4415 0.1967 H 1 UNL1111111111 0.2727 23 H 1.6671 1.4516 1.5042 H 1 UNL1111111111 0.3043 24 H 1.7080 -2.0976 1.0065 H 1 UNL1111111111 0.3417 25 H 3.8915 -0.9800 1.9043 H 1 UNL1111111111 0.3178 26 H 2.5073 3.3052 0.5504 H 1 UNL1111111111 0.2956 27 H 0.4455 -3.1991 -0.9194 H 1 UNL1111111111 0.3345 28 H -3.8027 2.8552 -0.3625 H 1 UNL1111111111 0.1985 29 H -3.8200 -2.3626 0.7040 H 1 UNL1111111111 0.5041 30 H -5.2244 -1.3544 0.6157 H 1 UNL1111111111 0.4938 @BOND 1 1 10 1 2 1 11 1 3 2 12 1 4 2 25 1 5 3 13 1 6 3 26 1 7 4 14 1 8 4 27 1 9 5 11 1 10 5 15 ar 11 5 16 ar 12 6 15 ar 13 6 17 ar 14 7 16 ar 15 7 19 ar 16 8 18 ar 17 8 19 ar 18 9 18 1 19 9 29 1 20 9 30 1 21 10 12 1 22 10 14 1 23 10 20 1 24 11 13 1 25 11 21 1 26 12 13 1 27 12 22 1 28 13 23 1 29 14 15 1 30 14 24 1 31 16 17 ar 32 17 18 ar 33 19 28 1