CHEMSTAR-ZINC04121949 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -2.0720 5.8770 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 6.3600 -4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 7.2700 -5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 7.7030 -4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 7.2200 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 6.3020 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 7.6790 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 8.4780 -4.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 7.2110 -2.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 7.6290 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 8.7540 -3.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 7.1610 -1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 7.5280 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 8.8560 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 9.2190 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 8.2570 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 6.9280 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 6.5670 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 5.7250 -0.0850 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 8.6250 -0.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6990 9.2310 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2030 9.4520 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4070 10.2280 -0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7590 9.7570 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 9.5230 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1680 11.3400 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4580 11.8790 -1.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6460 11.9010 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2720 13.1070 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6150 13.3860 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 12.4430 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5000 11.1330 2.6040 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 9.0810 -6.2570 I 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 5.1700 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 6.0240 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 7.6430 -6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 5.9240 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 6.5730 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 6.5690 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 9.6050 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 10.2520 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 5.5350 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 8.5650 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 10.1870 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7070 8.4900 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6040 10.0040 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2200 8.8230 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8660 10.5100 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7910 10.4760 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7990 9.0700 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4770 13.7740 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1170 14.3000 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4810 12.5050 4.4270 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 M END