IBS-ZINC05455813 MOE2007 3D Structure written by MMmdl. 44 47 0 0 0 0 0 0 0 0999 V2000 -3.0270 4.1810 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 3.0180 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 1.6510 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 1.0050 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 2.0080 0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 3.2170 -0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 1.9500 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9740 3.0550 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3370 3.0470 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9000 1.9430 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0980 0.8530 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7320 0.8550 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 -0.4580 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 1.0080 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 1.7130 -0.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 1.0060 -0.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 1.6890 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 1.1730 -0.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 0.1960 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 2.1730 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 2.1350 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 3.3700 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 4.5660 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 4.5870 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 3.3570 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 4.0680 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 5.1190 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 4.2730 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 3.9350 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9540 3.9040 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9600 1.9350 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5330 -0.0020 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 0.0000 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -0.8150 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -0.7090 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -1.0210 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -0.0820 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.0010 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 1.2120 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 3.4090 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 5.4980 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 5.4980 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.9990 -0.9340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3750 3.6080 -0.9280 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 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 43 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END