IBS-ZINC02199102 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.1380 1.4180 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.0370 -0.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6720 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 0.0540 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -0.5960 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.9740 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -2.7120 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0660 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.8250 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.0370 0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.1020 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.7230 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -0.0330 0.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 0.0960 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -0.3170 -1.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 0.7410 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 0.8760 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 1.4780 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 1.9490 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 1.8170 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 1.2120 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2010 2.5390 0.0400 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -2.8130 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -3.8550 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -4.5100 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -4.1040 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 -3.0650 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -2.4590 1.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.6980 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.7420 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.8970 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 1.1270 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -0.0280 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 -2.4700 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -3.7840 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 0.3610 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 0.5100 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 1.5840 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 2.1860 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 1.1050 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -4.1450 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -5.3190 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -4.5950 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 -2.7470 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 12 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 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 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 M END