OTAVA-ZINC01774963 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.8550 1.8710 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 0.4590 0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -0.3160 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -1.6970 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -2.4520 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -1.8300 0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -0.5120 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 0.2360 0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 0.0870 0.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 1.5120 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -3.8330 0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -4.7210 0.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -6.0790 -0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -4.2510 1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -4.2910 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -4.9990 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -4.6650 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 -3.6160 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 -2.9060 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -3.2490 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -3.2750 -5.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0970 -1.9890 -5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -1.1140 -4.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 -1.6410 -6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1800 -0.3090 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8900 0.0140 -7.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2880 -0.9900 -8.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9670 -2.3230 -8.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2530 -2.6450 -7.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0500 -0.6430 -10.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3290 0.5160 -10.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4340 -1.6130 -10.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1790 -1.1990 -12.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 2.3720 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 2.2230 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 2.0940 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.1740 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 1.9450 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 1.8620 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 1.8160 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -4.2800 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -5.8140 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -5.2180 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1620 -2.0900 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -2.7000 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -3.9640 -5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 0.4680 -6.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1380 1.0450 -8.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2750 -3.1000 -9.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -3.6750 -7.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4260 -2.0750 -12.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0980 -0.7000 -11.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5730 -0.5120 -12.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 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 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 M END