IBS-ZINC06764418 MOE2007 3D Structure written by MMmdl. 58 61 0 0 1 0 0 0 0 0999 V2000 9.0650 3.6660 4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 4.2200 3.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3290 4.3220 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 3.2950 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 5.3230 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 6.1500 2.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2720 6.2470 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9580 5.5210 3.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 7.5410 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 3.0580 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 1.8870 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 2.4230 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 1.5630 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 0.1830 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -0.5830 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.0320 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 1.4020 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 2.1660 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 2.0610 0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.3150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.0080 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.7510 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -1.9600 -0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -0.6670 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -1.5030 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -2.1330 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.9370 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -1.1100 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.4810 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -2.4890 -0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -3.3410 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1510 3.5950 4.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 4.3350 5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 2.6750 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 2.3190 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7300 3.1720 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 5.2160 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 5.7560 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0370 7.4890 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 8.0820 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7770 8.1230 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 2.7330 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0080 3.7090 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 1.1740 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 1.3870 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -0.3340 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.6570 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 3.2390 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.9720 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.6770 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -2.7700 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -0.9560 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 0.1460 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -2.7970 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -4.2190 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 -3.6940 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 3.9140 1.1650 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0340 3.9830 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 57 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 57 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 57 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 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 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END