IBS-ZINC05177982 MOE2007 3D Structure written by MMmdl. 47 51 0 0 0 0 0 0 0 0999 V2000 -0.0900 14.3140 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 13.0530 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 13.1030 -4.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 11.9620 -5.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 10.7210 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 10.6680 -3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 11.7900 -3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 11.3320 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 9.9670 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 9.5890 -2.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 8.6450 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 9.2580 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 9.9870 0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 11.3020 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 12.0430 -1.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 7.9220 -0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 7.2060 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 5.8520 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 5.0920 -0.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 5.8340 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 7.1690 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 3.7920 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 3.2460 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 1.9100 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.1160 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.6820 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 14.3400 -3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 15.2040 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 14.3690 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 14.0520 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 12.0400 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 9.8340 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 11.8240 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 7.0360 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 7.7690 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 5.3030 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 6.0220 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 6.0350 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 5.2610 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 6.9620 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 7.7240 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 3.8610 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 1.4970 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 0.0730 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 1.1300 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 2.9690 -0.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1260 3.3530 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 46 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END