IBS-ZINC02310428 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.0000 1.3890 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0090 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.6550 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 0.0480 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 1.4540 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.0980 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.4380 0.0150 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -0.9320 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -2.1750 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -2.0050 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -2.7540 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -3.3890 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -4.5030 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -3.1440 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 -1.8440 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -0.7370 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 -4.2770 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -4.7400 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 -6.4930 -2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1340 -7.7400 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 -6.8450 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -5.6190 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.9320 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.5670 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 2.0280 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -1.7920 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 -3.9690 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -5.1050 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -4.9840 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -3.9080 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -5.7400 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -6.7850 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 -8.5610 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 -8.0820 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 -6.5760 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1790 -7.6430 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -5.2810 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0160 -4.8090 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 -5.9250 -1.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 -7.4120 -2.4290 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1050 -8.2560 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 -6.7350 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 16 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 2 0 0 0 0 12 14 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 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 39 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 40 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END