OTAVA-ZINC00958424 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.5180 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.0120 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -0.5050 -1.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6530 -0.0620 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.0290 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.1160 -2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 0.1100 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.0150 -3.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.5170 -4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 0.7010 -5.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -0.3460 -6.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.2440 -7.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 0.9130 -7.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 2.0540 -7.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 1.9120 -6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 2.8620 -5.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 3.1720 -7.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 2.9750 -8.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 1.3080 -9.2410 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 4.0070 -9.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 5.1390 -8.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 3.7030 -10.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 4.7110 -11.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 6.0270 -10.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 7.0200 -11.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 6.7050 -12.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 5.3960 -12.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 4.3990 -11.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9190 2.9740 -11.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4710 7.7910 -12.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 4.5130 -6.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 1.8890 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.8850 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.8690 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.3800 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -0.3840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -2.3800 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -2.3220 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -2.4720 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.2600 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 1.4520 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -1.3030 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.7850 -10.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 6.2730 -10.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 8.0430 -11.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0390 5.1540 -12.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4840 2.4750 -12.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 2.9640 -11.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 2.4520 -10.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2130 8.2050 -12.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9730 7.3740 -13.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 8.5790 -13.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 4.5870 -6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 5.3050 -7.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 4.6160 -6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 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 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END