IBS-ZINC06757270 MOE2007 3D Structure written by MMmdl. 60 63 0 0 0 0 0 0 0 0999 V2000 4.3320 0.7720 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 1.4380 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 0.6720 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 1.2850 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 2.6730 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 3.4400 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 2.8240 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 3.3300 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 3.4500 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 3.0120 -2.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 4.1240 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 4.2910 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 4.9410 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 5.4200 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 5.2500 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 4.6000 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 4.4630 0.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 3.8280 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 3.7290 1.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 4.2030 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 4.7710 3.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 3.9140 4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 6.2480 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 7.2740 6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 5.4340 7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 4.4530 6.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 7.8270 8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 7.6910 9.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 7.3660 8.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 7.3810 8.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 0.5030 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 1.4360 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -0.1340 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -0.4100 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.6690 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 4.5200 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 3.4340 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 3.9200 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 5.0740 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 5.9270 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 5.6230 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 3.2570 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 2.9100 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 3.8840 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 6.2360 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 6.6000 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 7.3930 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 8.2430 5.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 5.5060 8.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 5.1300 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 3.4770 6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 4.3310 6.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 8.8180 8.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 7.6620 9.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 8.6220 9.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 6.8760 10.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 4.8940 5.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1620 4.9440 5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 6.8160 7.4210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6730 6.7630 7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 57 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 59 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 57 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 57 1 M CHG 1 59 1 M END