COMGENEX-ZINC06687683 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.5050 0.4550 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.8370 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -1.0420 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 0.0470 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 1.3420 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 1.5450 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -0.1690 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -0.7330 -1.3870 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1870 -1.7250 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -0.8300 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 0.1340 -0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 0.1580 -2.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 0.0470 -3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -0.8860 -3.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 1.1920 -4.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1630 1.2270 -4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 2.5200 -4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 2.5900 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.7750 -5.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 1.0120 -5.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 3.5340 -4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 3.3850 -5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 4.2600 -4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 5.2870 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 5.4420 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 4.5680 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 0.6130 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.6880 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -2.0540 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 2.2030 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 2.5520 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 0.7830 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -0.8400 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 0.8590 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 2.5590 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 3.3420 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 2.5850 -5.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 4.1410 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 5.9700 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 6.2490 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 4.7190 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -1.8370 0.1120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 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 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M CHG 1 42 -1 M END