OTAVA-ZINC00940844 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.4400 1.0900 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -0.4350 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -0.8010 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -2.1200 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -2.9370 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.5680 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -2.8280 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -3.2270 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 -3.3010 -0.7290 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -2.7830 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -2.6060 -2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -2.8450 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 -3.2160 -3.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -2.6560 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -2.9000 -5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -2.5720 -7.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -3.3100 -8.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -2.9990 -9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -1.9510 -9.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -1.2150 -8.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -1.5130 -7.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -1.6470 -11.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -2.2190 -5.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.8720 -5.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -2.6670 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.9330 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -1.7860 4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -2.3670 5.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -3.0980 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -3.2540 2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.2190 6.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8430 6.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 1.3690 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.5020 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 1.4840 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.8300 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.8480 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -3.4710 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -2.3100 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -3.3340 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -4.1240 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -3.5670 -10.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.4030 -8.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -0.9380 -6.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -0.9980 -11.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -1.4800 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -1.2180 5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -3.5480 4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -3.8280 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -3.9180 6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.4390 5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6480 7.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 25 1 0 0 0 0 8 9 1 0 0 0 0 8 38 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 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 40 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 3 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END