IBS-ZINC02267724 MOE2007 3D Structure written by MMmdl. 54 56 0 0 1 0 0 0 0 0999 V2000 -4.5450 7.4120 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 5.2780 3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 5.2030 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 5.6050 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 3.5620 -0.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8560 2.8920 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.3760 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.0000 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 1.5370 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 3.0630 -1.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3260 3.2440 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 3.8160 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 5.3260 -1.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3620 5.7970 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 5.8240 -0.4170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4330 7.3730 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 7.7420 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 7.2290 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 5.7280 -2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 5.6970 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 5.6150 1.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 3.0430 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 2.6620 -0.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 7.3800 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 7.8920 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 7.9470 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 4.2980 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 5.8640 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 5.1800 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 5.3730 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 4.1570 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 5.3730 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 6.6900 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 3.3140 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 3.0810 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 0.8760 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 1.0100 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -0.0910 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.3860 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 1.2740 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 1.0200 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 3.5710 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 3.4980 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 7.8450 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 7.8550 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 8.8320 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 7.3310 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 7.7490 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 7.4520 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 5.4020 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 5.2340 -2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 5.9980 2.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4340 6.0500 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 5.0810 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 52 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 52 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 3 0 0 0 0 22 23 3 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END