CHEMBRIDGE-ZINC00180557 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.0350 -2.7490 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0500 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.6640 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0550 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7720 -1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.0960 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.7760 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8140 -2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -2.1660 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.4550 -3.5640 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -2.8660 -4.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -2.2190 -5.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -1.0030 -5.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -2.9820 -7.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.4380 -8.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -3.5640 -9.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -3.6750 -10.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -4.9110 -11.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -6.0570 -10.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -5.9700 -9.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.7220 -8.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -4.3280 -7.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -2.9280 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -3.7010 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.1240 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0680 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 1.0230 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.8550 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -3.7790 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -3.8360 -4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -1.3880 -8.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -2.7870 -11.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.9980 -12.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -7.0280 -10.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -6.8680 -8.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 M END