IFLAB-ZINC04315331 MOE2007 3D Structure written by MMmdl. 51 54 0 0 1 0 0 0 0 0999 V2000 2.7820 2.9580 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 2.5830 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.2780 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.9390 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 1.8970 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 3.2230 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 3.5500 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 4.3050 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 4.6950 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 4.5520 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 5.3370 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 4.9380 3.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8850 3.8940 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 5.0470 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 5.6920 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 7.0230 3.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 7.7050 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3770 7.3590 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 8.5940 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4140 8.5510 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1200 7.3300 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4610 6.0910 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 6.1530 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 1.4760 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 3.2870 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 3.7650 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 2.1070 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 0.5130 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.0880 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 4.5720 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 5.3070 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 4.2090 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 4.0470 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 5.7310 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 4.9010 4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 3.4920 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 6.4110 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 5.1690 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 6.0870 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 4.6360 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4610 9.5240 3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9740 9.4850 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2090 7.3520 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9960 5.1510 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 1.6610 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 2.0180 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 0.4060 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 5.1610 3.2360 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3240 4.1670 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 4.2640 1.6580 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8610 3.2720 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 48 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 48 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 48 1 M CHG 1 50 1 M END