OTAVA-ZINC05413611 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -2.7460 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -3.2630 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -3.3720 -0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -2.7090 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -2.4910 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -2.8080 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -3.2840 -3.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -2.5700 -4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -2.9930 -5.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -2.8690 -7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1230 -3.2710 -8.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -3.1470 -9.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -2.6250 -9.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -2.2240 -9.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -2.3390 -7.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -1.5700 -9.5740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.6930 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -3.8340 3.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3560 -4.6980 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -2.5670 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -2.5230 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 -4.0220 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -2.1100 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -1.5090 -5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -3.1440 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -3.3600 -5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -3.6790 -7.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -3.4590 -10.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -2.5290 -10.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -2.0220 -6.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -2.9410 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -4.6510 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -1.6890 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -2.5780 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -3.3080 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -1.5500 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6120 -4.9200 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -4.1220 5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -3.1570 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END