HMDB0250222 RDKit 3D Carbamic acid, (5-amino-1,2-dihydro-3-(4-methylphenyl)pyrido(3,4-b)pyrazin-7-... 43 45 0 0 0 0 0 0 0 0999 V2000 6.9385 -1.4102 -0.8869 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0489 -1.4198 0.3186 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0334 -0.4416 0.2104 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2984 0.9133 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 1.2764 0.0627 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2383 1.8550 -0.0229 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8888 1.3808 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8344 2.2643 -0.0939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5218 1.7924 -0.0652 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2975 0.4485 0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3633 -0.4109 0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1595 -1.8332 0.2952 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6037 0.0790 0.1283 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0461 0.0271 0.0858 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0677 0.7901 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3985 0.1403 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5098 -1.2253 0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7279 -1.8739 0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -1.1217 0.1343 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1886 -1.8386 0.1867 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7846 0.2380 0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5496 0.8711 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9225 2.2244 -0.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5805 2.6700 -0.1646 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5103 -2.3266 -1.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6702 -0.5677 -0.7888 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3019 -1.2740 -1.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5122 -2.4044 0.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5895 -1.2965 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4733 2.8540 -0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3218 -0.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7639 -2.3560 -0.4936 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4059 -2.3329 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5764 -1.8015 0.2434 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7123 -2.9484 0.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 -2.8407 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8422 -1.1980 0.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 -1.9785 -0.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7155 0.7903 -0.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 1.9291 -0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5492 2.6607 -0.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3985 2.6765 0.7957 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3154 3.6972 -0.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 2 0 10 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 15 23 1 0 23 24 1 0 13 7 1 0 22 16 1 0 24 9 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 6 30 1 0 8 31 1 0 12 32 1 0 12 33 1 0 17 34 1 0 18 35 1 0 20 36 1 0 20 37 1 0 20 38 1 0 21 39 1 0 22 40 1 0 23 41 1 0 23 42 1 0 24 43 1 0 M END