CHEMBRIDGE-ZINC00992002 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0270 1.4890 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0180 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.7180 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7880 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.0730 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.6950 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2590 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.8760 1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -5.0000 -1.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6210 -4.5030 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -5.0100 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -6.3650 -1.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -6.9670 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -6.3670 -3.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -8.3520 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -9.0810 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -10.3760 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -10.9610 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -10.2530 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -8.9450 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -8.2280 -4.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -8.4150 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -9.1360 -4.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -7.7420 -6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -6.9140 -6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -6.2880 -7.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -6.4790 -8.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -7.3010 -7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -7.9390 -6.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -7.4860 -8.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -6.8020 -9.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 1.8680 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8530 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.8360 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1830 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.6420 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.6000 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.1420 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -5.5460 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -3.9860 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -5.5070 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -8.6310 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -10.9380 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -11.9760 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -10.7160 -3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -7.5940 -4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -6.7620 -6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -5.6460 -8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -5.9860 -9.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0370 -8.5820 -6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 -7.0350 -10.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 -5.7270 -9.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -7.1230 -10.4490 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 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 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END