CHEMBRIDGE-ZINC01119611 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0300 1.5070 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0780 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -0.5750 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 0.1430 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -0.5290 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.9330 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -2.6440 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -1.9700 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.6710 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -4.0960 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -2.6100 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -3.7820 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -4.2000 1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -4.5730 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 -5.8320 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -5.8320 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -6.9870 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -8.1430 2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -8.1440 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -6.9900 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -9.3800 3.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9920 -9.3790 4.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 -10.3990 3.2100 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.8440 0.2320 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -0.3500 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 1.9000 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 1.8660 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.8430 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 1.2220 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -3.7240 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -4.4070 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -4.5310 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -4.4370 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -2.2380 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -3.9730 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -4.8330 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -4.9280 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 -6.9860 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -9.0470 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -6.9910 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 1.5750 0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 2.0310 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END