IBS-ZINC05100856 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.1610 1.2770 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.2250 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -0.5790 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -2.0670 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -2.7800 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -4.2200 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -4.8410 1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -4.8530 -0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -4.1390 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -2.7570 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -2.1060 -2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.8240 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.2020 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.8880 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -6.3820 -2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -8.3640 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -8.7780 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -6.9190 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -6.4580 -3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -8.7810 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -4.9120 -4.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -1.9900 -4.6780 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 1.5090 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 1.7980 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.6720 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.5890 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.7160 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -0.1990 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -0.0460 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -2.3190 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -1.0360 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -6.7780 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -6.8570 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -8.5930 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -8.8550 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -9.8690 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 -8.3440 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -6.3670 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -6.6520 -3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -6.9120 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -5.3670 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 -8.3080 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 -9.8680 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 -8.5220 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -4.2910 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -6.8670 -2.4930 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7810 -6.4160 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -8.3710 -2.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 46 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 48 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 46 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 48 1 0 0 0 0 21 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END