IFLAB-ZINC04375789 MOE2007 3D Structure written by MMmdl. 52 55 0 0 0 0 0 0 0 0999 V2000 4.3160 8.9400 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 8.0470 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 6.8010 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 5.9900 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 6.4130 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 7.6820 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 8.4850 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 8.2370 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 5.5520 -0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 4.1670 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 3.7470 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 4.9640 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 6.0400 -0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 2.3610 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 1.5130 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 2.0000 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 1.8320 0.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 2.5370 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 0.5840 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 0.7700 -1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -0.5250 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -1.6870 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -1.8700 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -0.5800 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 9.5870 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 8.3500 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 9.5650 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 6.4650 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 5.0710 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 9.4710 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 8.5680 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 9.1030 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 7.4950 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 5.1170 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 0.4340 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 1.3490 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 3.0450 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 3.2690 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 1.8490 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 0.3130 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 1.0830 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 1.5660 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -0.7690 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -0.3810 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -2.6100 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 -1.5050 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 -2.1960 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -2.6650 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -0.7390 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -0.3480 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 3.3120 -0.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7240 3.6590 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 51 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 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 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END