IBS-ZINC05451715 MOE2007 3D Structure written by MMmdl. 54 57 0 0 0 0 0 0 0 0999 V2000 3.3670 9.3290 -7.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 7.8760 -8.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 5.5980 -7.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 4.7140 -6.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 6.1700 -4.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 7.0540 -5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 3.8920 -4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 3.8060 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 4.4300 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 3.0370 -2.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 2.9590 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.1620 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 2.0820 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 1.3960 2.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 2.8580 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 2.8340 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 3.5760 1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 4.3420 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 4.3740 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 3.6340 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.6560 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0130 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 9.9940 -8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 9.5460 -7.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 9.4840 -6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 7.6590 -8.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 7.7220 -9.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 5.2330 -7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 5.5670 -8.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 3.6820 -7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 5.0620 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 6.5350 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 6.2010 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 6.7060 -6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 8.0860 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 2.9800 -4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 4.2600 -4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 2.5390 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 2.2370 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6180 3.5600 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 4.9200 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 4.9740 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.7650 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -0.5200 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 6.9890 -7.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 4.7800 -5.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 53 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 54 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 7 54 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END