OTAVA-ZINC05332925 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.8220 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -1.2680 -3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -1.3830 -3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.0520 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -0.5990 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -0.2580 -0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -0.3740 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 0.0510 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 0.4140 2.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 0.0280 1.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6850 0.4180 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 0.4300 2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 0.8860 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 1.1980 4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 0.9540 3.9560 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 0.9920 4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0130 2.1660 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2740 2.2600 6.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1480 1.1900 6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7640 0.0220 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 -0.0850 4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5240 1.2980 6.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0760 0.0280 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5900 0.8520 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4810 -1.2580 1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5360 -1.5860 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8590 -3.0780 1.1480 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -0.7340 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.5280 -4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -1.7330 -4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -1.1420 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.0540 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -1.4080 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 0.2680 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 -0.2630 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 1.5560 5.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 3.0020 5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5800 3.1690 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4500 -0.8100 5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 -0.9980 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4930 0.9600 7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2180 0.6760 6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8560 2.3360 6.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2060 -1.3490 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -1.0060 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6510 -3.3240 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 -3.3150 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9670 -3.6590 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 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 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END