HMDB0255230 RDKit 3D N-Phenylnicotinamide 25 26 0 0 0 0 0 0 0 0999 V2000 -0.0961 -1.6486 -0.3549 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6032 -0.3671 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2065 0.6496 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6019 0.3862 -0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 1.1888 -0.8279 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8038 0.9739 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -0.0670 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5382 -0.8853 0.6506 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1844 -0.6383 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.1838 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5895 1.0956 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9507 1.1944 -0.0596 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7716 0.0907 -0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -1.1156 -0.3634 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8692 -1.2581 -0.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3137 -1.9720 -1.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0118 1.9960 -1.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4167 1.6217 -1.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3998 -0.2434 -0.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0171 -1.6791 1.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5489 -1.2673 1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9405 1.9447 0.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3932 2.1841 0.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8389 0.2691 -0.2149 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4999 -2.2692 -0.4804 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 2 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 9 4 1 0 15 10 1 0 1 16 1 0 5 17 1 0 6 18 1 0 7 19 1 0 8 20 1 0 9 21 1 0 11 22 1 0 12 23 1 0 13 24 1 0 15 25 1 0 M END