IBS-ZINC05025094 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -2.5130 1.5390 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 0.1140 -2.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -0.5780 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 0.1020 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -0.6000 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -1.9810 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -2.6660 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -1.9620 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -4.0640 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -4.7350 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -6.8540 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -6.1210 -0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -4.7770 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -3.9560 -0.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0650 -6.7370 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -7.9350 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -9.1660 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -10.2400 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -10.0510 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -8.8660 -3.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 -7.8230 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 1.9660 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 1.9060 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 1.8310 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 1.1810 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -0.0690 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.5270 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.4920 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -4.8920 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -4.1160 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -7.7880 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -7.0700 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -6.6100 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8690 -6.0640 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -7.0650 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -9.2840 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -11.2130 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -10.8830 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 -6.8690 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -6.0330 -0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 40 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 M END