IBS-ZINC06759265 MOE2007 3D Structure written by MMmdl. 54 58 0 0 0 0 0 0 0 0999 V2000 4.9540 2.9420 6.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 2.7530 6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 3.5790 6.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 3.3830 6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.3550 5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 1.5180 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 1.7130 5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.1530 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 2.3090 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 2.0400 4.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 1.6840 3.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.7680 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 1.5070 2.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.1720 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 1.0450 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 1.2920 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 1.1870 1.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 0.6780 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8610 1.7720 3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 2.2860 2.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 2.6900 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 1.5990 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 2.4290 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8560 1.5420 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2330 1.7610 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7560 2.8680 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8870 3.7300 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.8810 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 2.3600 7.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 2.6210 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 3.9970 7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 4.3840 7.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 4.0540 6.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 0.6980 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 1.0440 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 2.6060 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 0.7270 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -0.1820 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 0.2980 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 2.6130 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 1.3740 4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 3.6210 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 2.8870 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 1.9950 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 0.7250 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4620 0.6570 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 1.0650 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8260 3.0580 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2150 4.6240 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 0.0310 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 1.7560 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.6460 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5700 3.4860 1.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9420 4.1520 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 53 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 53 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END