CHEMDIV-ZINC04057519 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.6110 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -4.2120 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -4.9000 -4.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -4.1640 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -3.5650 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -6.1720 -4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -6.7640 -4.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -6.8580 -4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -8.2610 -5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -9.4160 -4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -9.6340 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -10.8950 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -11.9680 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -11.7800 -4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -10.5030 -5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.0090 -6.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -10.5330 -7.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -8.6460 -6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -7.7540 -7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -6.5640 -7.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -11.1600 -1.0060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0180 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -3.0040 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -4.4140 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -3.4160 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.9250 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -3.3640 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -4.8450 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -4.3680 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -2.9250 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -6.8930 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -6.3050 -5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -8.8060 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -12.9600 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -12.6200 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -8.2550 -9.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -7.6290 -9.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 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 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 53 54 1 0 0 0 0 M END