IBS-ZINC02226847 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.2790 2.5640 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 1.2490 1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 0.2420 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 0.4540 3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.1510 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -2.0610 2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.7110 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -3.5660 4.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -4.1720 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -3.7740 5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.6430 3.7760 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -4.2420 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -5.5050 6.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -5.2480 7.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -5.1540 6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -3.7450 4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -4.4890 5.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -3.0750 3.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -2.2560 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -1.6700 1.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -3.2360 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -4.2310 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -4.3880 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 -3.5560 2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 -2.5640 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -2.3990 3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1240 -1.5230 4.6810 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.8640 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 3.2840 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 2.5320 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -1.4830 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -1.1500 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -3.4620 6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -4.4670 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -5.7510 7.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -6.3330 6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -4.3120 7.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -6.0670 8.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -6.1360 5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -4.8030 6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -4.8820 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 -5.1620 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 -3.6810 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -1.6220 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 44 1 0 0 0 0 M END