IBS-ZINC02202076 MOE2007 3D Structure written by MMmdl. 63 67 0 0 1 0 0 0 0 0999 V2000 0.7920 2.7730 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 1.6000 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 1.0050 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 0.5030 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 0.9380 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.1750 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 1.5810 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 1.7530 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 1.5180 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 1.1130 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 2.2550 4.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6370 1.9000 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 1.7110 5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 3.7730 4.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 5.9110 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 7.0780 3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 8.2590 3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 8.2490 4.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 7.0600 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 5.8910 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 4.5470 4.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 4.0700 5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 4.3560 6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 4.6670 7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 4.9230 8.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 4.8610 9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 4.5300 8.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 4.2640 7.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 3.9150 7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4780 3.8460 7.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 4.1200 9.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1490 4.4580 9.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 3.5160 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 3.2800 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 2.4370 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.9890 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 0.1920 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.7640 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 0.6040 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.3720 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 0.1480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 1.0470 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 1.7590 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 1.6490 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 0.9310 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 2.1710 5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 1.9320 6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 0.6250 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 7.0680 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 9.2090 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 9.1940 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 7.0500 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 4.5750 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 2.9950 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 4.7190 6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 5.1700 9.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 5.0640 10.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4780 3.6820 5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4380 3.5760 7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 4.0680 9.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 4.6640 10.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 4.6060 3.4520 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0460 4.2910 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 21 1 0 0 0 0 14 62 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 15 62 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END