HMDB0014745 RDKit 3D Nafcillin 51 54 0 0 0 0 0 0 0 0999 V2000 -1.9996 -3.1994 1.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9918 -2.8112 -0.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.4471 -0.3228 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6676 -0.4258 0.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8006 -0.7207 0.7942 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6385 0.2817 1.1881 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3302 1.5825 0.8449 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1938 2.5744 1.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9669 3.9007 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8459 4.2090 0.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9658 3.2035 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1841 1.8763 0.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3232 0.8842 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1259 1.1591 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 2.1825 -1.7895 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0764 0.3840 -1.0082 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1874 0.7933 -1.7999 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8834 -0.2688 -2.5675 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -0.8164 -3.6684 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.4027 -1.6269 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0456 -0.8935 -0.8798 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2280 -0.0874 -1.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3642 -0.3087 -0.6493 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 1.0006 -2.0758 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -0.9390 0.5736 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -0.7095 1.4777 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 -2.2091 0.9789 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5122 0.4948 0.6745 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 0.9096 -1.1117 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9533 -2.3163 2.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1309 -3.8475 1.6513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9338 -3.7540 1.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9251 -3.2049 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1569 -3.3338 -0.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0525 -1.7291 1.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5551 0.0708 1.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0937 2.3069 1.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6662 4.6477 1.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6246 5.2404 0.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0985 3.4968 -0.7071 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0968 -0.4554 -0.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9721 1.7170 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2671 -1.9381 -1.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5253 0.7513 -3.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5793 -0.8755 2.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -1.4464 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2967 0.2978 1.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7652 -2.9673 1.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2521 -2.5929 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.0206 1.9844 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1325 1.7565 -1.3911 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 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 21 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 28 29 1 0 13 4 1 0 29 17 1 0 12 7 1 0 29 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 5 35 1 0 6 36 1 0 8 37 1 0 9 38 1 0 10 39 1 0 11 40 1 0 16 41 1 0 17 42 1 6 21 43 1 6 24 44 1 0 26 45 1 0 26 46 1 0 26 47 1 0 27 48 1 0 27 49 1 0 27 50 1 0 29 51 1 1 M END