IBS-ZINC06760075 MOE2007 3D Structure written by MMmdl. 57 61 0 0 0 0 0 0 0 0999 V2000 1.6840 12.4510 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 12.3360 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 11.8420 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 11.4560 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 10.0210 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 9.2550 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 9.8770 -1.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 11.2420 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 12.0240 -0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 11.5240 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 10.2930 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 9.2980 -2.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 12.8300 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 14.0040 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 15.2510 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 15.3400 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 14.1800 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 12.9320 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 7.8910 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 6.9810 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 5.8140 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 5.1660 -0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 6.0810 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 7.2050 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 3.8060 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 3.1500 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 1.7590 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 1.0220 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.6980 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 11.4970 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 13.1880 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 12.7670 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 13.3430 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 11.7240 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 12.5550 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 10.8740 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 9.6490 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 10.0770 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 13.9600 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 16.1520 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 16.3100 -5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 14.2460 -6.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 12.0450 -5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 6.5910 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 7.4920 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 5.1030 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 6.1870 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 6.5040 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 5.5680 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 6.7720 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 7.8900 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 3.7140 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 1.2550 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0620 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 1.1970 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.0360 -1.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9990 3.5180 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 38 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 56 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END