IBS-ZINC06719447 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.6160 -4.5800 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.6700 -5.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.9100 -4.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.8480 -5.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.8200 -6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -2.4570 -8.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -3.6960 -8.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -4.7240 -7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -4.0890 -5.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -3.8840 -9.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -3.0280 -9.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -5.1600 -9.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6690 -5.3090 -8.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -6.3460 -9.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -7.5370 -9.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -7.4770 -10.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -8.6540 -10.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 -8.6090 -11.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -7.3920 -11.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -6.2150 -11.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -6.2530 -10.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -5.0850 -10.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -1.4280 -6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.0110 -6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -1.7680 -8.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -2.6870 -8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -5.5330 -7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -5.1160 -7.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -4.7800 -5.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -3.8630 -5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -6.1990 -10.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -6.4310 -8.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -9.6070 -10.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -9.5270 -11.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -7.3600 -12.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -5.2650 -11.4680 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 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 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 M END