Inosine (4TMS) http://gmd-dev.mpimp-golm.mpg.de/search.aspx?query=cf762f70-e9b1-43a3-bc8a-8975e08e7073 35 37 0 0 0 0 0 0 0 0999 V2000 2.0268 -1.6711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2731 -2.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 -1.5218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -1.7767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4339 -2.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6639 -1.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4889 -1.1093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 -0.6968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4339 0.3428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 1.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4339 1.6777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2185 1.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 1.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 2.6602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6475 1.4227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6475 0.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 0.1852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2185 0.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -1.8213 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1162 -3.1723 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0 -0.4948 -3.7224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7272 -2.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6663 -3.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6919 -2.1544 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0 2.2086 -2.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1751 -1.4893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -2.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 3.0713 0.0000 Si 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 3.4824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2339 3.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0561 2.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 4 5 1 1 4 6 1 0 6 7 1 1 6 8 1 0 8 9 1 0 3 9 1 0 8 10 1 6 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 13 19 2 0 10 19 1 0 7 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 5 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 1 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 15 32 1 0 32 33 1 0 32 34 1 0 32 35 1 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 20 21 22 23 M SBL 1 1 22 M SMT 1 ^TMS M SCL 1 M SBV 1 22 0.4111 0.7120 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 4 24 25 26 27 M SBL 2 1 26 M SMT 2 TMS M SCL 2 M SBV 2 26 -0.5501 0.6110 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 4 28 29 30 31 M SBL 3 1 30 M SMT 3 TMS M SCL 3 M SBV 3 30 -0.6651 0.4832 M STY 1 4 SUP M SLB 1 4 4 M SAL 4 4 32 33 34 35 M SBL 4 1 34 M SMT 4 ^TMS M SCL 4 M SBV 4 34 0.7120 -0.4111 M END