IBS-ZINC05207265 MOE2007 3D Structure written by MMmdl. 52 55 0 0 0 0 0 0 0 0999 V2000 -0.9160 -1.7640 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -1.1180 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 0.0080 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 1.4030 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 1.9960 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 3.3030 0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 3.5210 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 2.4660 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 1.1880 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 0.9500 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -0.2670 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 0.0770 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 0.0380 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -1.4110 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 -1.4870 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2960 -2.8770 -0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 -3.6670 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -4.8860 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -3.5920 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 4.9560 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 2.1590 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 1.9490 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 2.6670 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 3.5990 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 3.8180 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 3.1010 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -2.5730 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -1.0380 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.1880 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -1.8790 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -0.7680 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 2.7570 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -0.8060 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 0.5600 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2140 0.5520 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -1.9430 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -1.9340 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -0.9990 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 -0.9790 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2690 -3.2500 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1900 -5.8090 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -3.2510 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 5.4260 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 5.0290 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 5.4920 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 1.2370 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 2.5000 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 4.1590 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 4.5470 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 3.2850 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9990 -4.8060 -0.7710 N 0 3 0 0 0 0 0 0 0 0 0 0 9.2930 -5.5570 -1.3890 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 51 1 0 0 0 0 19 42 1 0 0 0 0 19 51 2 0 0 0 0 20 43 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END