@MOLECULE 1-(beta-d-ribofuranosyl)-5,6-dihydro-1h-imidazo[4,5-d]pyridazine-4,7-dione 32 34 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* 1.8349 -0.2496 -1.0521 O.3 1 UNL1 -0.4073 2 O2* 1.9357 2.4614 0.9708 O.3 1 UNL1 -0.5004 3 O3* 4.2029 1.3669 0.4973 O.3 1 UNL1 -0.5288 4 O5* 2.9503 -2.7170 -1.3260 O.3 1 UNL1 -0.5104 5 O -1.4049 2.3271 -1.1353 O.2 1 UNL1 -0.4867 6 O -4.5424 -1.5837 0.7155 O.2 1 UNL1 -0.4116 7 N -0.1501 -0.1961 0.1154 N.ar 1 UNL1 -0.2535 8 N -1.4624 -1.8655 0.8997 N.ar 1 UNL1 -0.2979 9 N -3.4185 1.3581 -0.8485 N.ar 1 UNL1 -0.3953 10 N -4.2185 0.4806 -0.0924 N.ar 1 UNL1 -0.4345 11 C1* 1.0193 0.5890 -0.2752 C.3 1 UNL1 0.2154 12 C2* 1.8337 1.0741 0.9589 C.3 1 UNL1 0.0341 13 C3* 3.2260 0.4003 0.8001 C.3 1 UNL1 0.0408 14 C4* 3.1148 -0.4746 -0.4568 C.3 1 UNL1 0.0281 15 C5* 3.2312 -1.9750 -0.1635 C.3 1 UNL1 -0.0459 16 C -1.4634 0.1830 -0.0917 C.ar 1 UNL1 -0.0979 17 C -0.1904 -1.4618 0.7120 C.ar 1 UNL1 0.0959 18 C -2.2649 -0.8593 0.4144 C.ar 1 UNL1 -0.0152 19 C -2.0239 1.3835 -0.6901 C.ar 1 UNL1 0.5712 20 C -3.7198 -0.7779 0.3598 C.ar 1 UNL1 0.5702 21 H1* 0.6999 1.4317 -0.9544 H 1 UNL1 0.2086 22 H2* 1.3399 0.8494 1.9290 H 1 UNL1 0.1724 23 H3* 3.5382 -0.1536 1.7075 H 1 UNL1 0.1399 24 H4* 3.8328 -0.1580 -1.2544 H 1 UNL1 0.1893 25 H5*1 2.5587 -2.3075 0.6468 H 1 UNL1 0.1155 26 H5*2 4.2727 -2.2608 0.0853 H 1 UNL1 0.1583 27 H 0.6878 -2.0305 0.9721 H 1 UNL1 0.1972 28 H2* 2.3930 2.7978 0.1578 H 1 UNL1 0.3357 29 H3* 4.2989 2.0051 1.2428 H 1 UNL1 0.3327 30 H5* 2.0806 -2.4328 -1.6932 H 1 UNL1 0.3257 31 H -3.8895 2.2522 -1.0270 H 1 UNL1 0.3298 32 H -5.1936 0.4911 -0.4177 H 1 UNL1 0.3246 @BOND 1 30 4 1 2 4 15 1 3 24 14 1 4 5 19 2 5 1 14 1 6 1 11 1 7 31 9 1 8 21 11 1 9 9 19 ar 10 9 10 ar 11 19 16 ar 12 14 15 1 13 14 13 1 14 32 10 1 15 11 7 1 16 11 12 1 17 15 26 1 18 15 25 1 19 10 20 ar 20 16 7 ar 21 16 18 ar 22 7 17 ar 23 28 2 1 24 20 18 ar 25 20 6 2 26 18 8 ar 27 3 13 1 28 3 29 1 29 17 8 ar 30 17 27 1 31 13 12 1 32 13 23 1 33 12 2 1 34 12 22 1