IBS-ZINC02118866 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 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 1.1770 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.0960 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -2.6950 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.7950 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -2.1790 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -0.7730 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -0.1330 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -0.8730 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 -2.2640 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -2.9140 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -4.4200 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -3.0070 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -2.3460 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -0.1600 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 -0.4780 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -1.3630 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0120 -2.3500 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9750 -3.1620 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3320 -2.9880 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7250 -2.0000 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7650 -1.1840 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1720 -1.7810 -4.3180 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 0.0630 -0.0220 C 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 -2.5390 0.9460 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -4.7890 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -4.8120 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -4.7490 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -2.9840 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -2.1320 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 0.2020 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 0.6840 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 0.5000 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5610 -0.3640 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7340 -2.4880 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 -3.9340 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0840 -3.6230 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2940 -0.4100 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 0.2380 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -0.5260 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 1.0180 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -1.0880 -0.3200 N 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 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 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 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 46 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END