IFLAB-ZINC04483169 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 69 0 0 1 0 0 0 0 0999 V2000 0.4170 2.1970 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.6690 -0.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2620 0.1690 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.4120 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.4010 1.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6110 -1.4600 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 0.0730 0.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9640 1.1090 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 0.0160 -0.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4870 0.5040 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -1.4320 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.4080 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 0.0580 -1.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8740 0.5760 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 0.1170 -1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -0.8380 -1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 1.3690 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 1.1750 -1.8370 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6190 0.6880 -2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 0.4910 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 0.8130 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 1.3230 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 1.4970 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -0.8110 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -0.8330 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -0.5380 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -0.1760 3.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5260 1.2800 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 1.6680 4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 0.4880 5.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0410 0.8370 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -0.5280 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.0990 5.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -1.0470 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 2.6060 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 2.5030 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 2.5700 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -0.8980 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.7010 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 0.0980 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.4720 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -2.0780 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -1.7800 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -2.0490 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -1.7430 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 1.5830 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 2.2040 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 0.4400 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 0.0910 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 0.6700 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 1.5850 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 1.8970 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -0.4120 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -1.8250 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -1.1110 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.4080 4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 1.9230 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 2.4900 5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 1.9920 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -0.2660 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -1.5070 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -0.8430 6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -0.4430 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -1.4520 4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -1.8660 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 M CHG 1 18 1 M END