CHEMBRIDGE-ZINC00229525 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.8230 1.2260 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0100 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -0.3100 1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -1.5300 1.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -1.7940 2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.9730 3.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -3.0750 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -3.4930 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -4.7660 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -5.0540 2.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -4.0890 2.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -4.0820 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -5.6500 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -5.4330 4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -4.9980 6.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.8780 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -1.4620 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -2.2730 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -2.5100 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -1.9350 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -1.1170 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -3.3820 -4.4090 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4930 -3.8900 -4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -3.5920 -5.2920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8790 0.9750 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.6140 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.9820 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1840 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -2.9500 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -6.6720 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0490 -4.6490 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 -6.3110 5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -5.5910 6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -3.9300 6.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -1.2780 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -2.7250 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -2.1240 -3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -0.6650 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 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 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 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 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END