IBS-ZINC02106887 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 3.5050 -6.9360 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -5.8400 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -5.4720 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.4750 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -3.8600 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.2030 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -5.2170 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -3.3720 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -2.5730 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.8630 -0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -2.4010 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -1.5580 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -1.3990 -3.3170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2380 -3.2160 -3.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -3.8630 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -4.7790 -4.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -3.3960 -6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -4.3050 -7.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -3.9180 -8.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -2.6120 -8.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -1.6840 -7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.0830 -6.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.4260 -8.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 0.4510 -7.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -2.2170 -10.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -2.4250 -10.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -4.7270 -9.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -6.0100 -9.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -7.9000 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -6.7640 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.9820 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -5.9630 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -4.1900 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -5.5260 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -2.4930 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -5.3110 -6.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -1.3680 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 0.0050 -6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.7530 -6.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 1.3530 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -1.8130 -9.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -2.1200 -11.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -3.4830 -10.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -5.9300 -8.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -6.6430 -8.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -6.4880 -10.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.9270 -1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 14 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 47 2 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M CHG 1 13 -1 M END