IBS-ZINC05026470 MOE2007 3D Structure written by MMmdl. 60 62 0 0 0 0 0 0 0 0999 V2000 3.1130 -3.1630 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -4.1640 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -5.8200 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -6.8830 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -3.3360 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -3.1910 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -2.1600 -0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -2.3940 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -3.5550 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -3.4050 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -2.1560 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -0.9950 -1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -1.1620 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.8510 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.2730 -1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 1.1680 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 1.6660 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 2.1900 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 2.6740 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 2.6520 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 2.0910 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 1.6060 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 3.1630 -0.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 3.0770 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 3.8240 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -3.5340 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -2.1940 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -2.9980 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -3.8080 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -5.1070 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -5.9770 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -5.8230 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -7.8670 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -6.6950 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -6.9330 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.3900 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -3.5640 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.1370 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -2.9280 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -4.5180 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -4.2790 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -2.0930 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0300 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -0.7930 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 1.3990 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 1.6550 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 2.2520 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 3.0850 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 2.0330 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 1.2040 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 3.6570 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 3.4740 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 2.0360 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 3.1230 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 4.2100 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 4.6800 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.2570 -1.4590 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8200 0.7260 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.4380 1.3260 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1080 -4.4510 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 59 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 59 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 57 2 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 57 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 57 1 M CHG 1 59 1 M END