CHEMBRIDGE-ZINC04046656 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0790 1.1230 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.2420 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.8100 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -0.0230 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 1.3530 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.9570 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 3.3110 0.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 4.0740 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 5.4350 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 5.3670 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 4.0100 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -0.5630 -0.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 0.1870 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -0.7100 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4770 -1.0540 -2.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -1.2260 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.2560 -0.4460 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1950 -2.8550 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -2.7990 -0.6190 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0520 1.5220 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.8410 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 1.9870 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 3.5430 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 4.2230 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 5.3180 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 6.0740 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 5.9610 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 5.2480 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 4.1700 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 3.4260 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -1.5870 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 1.0450 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 0.5440 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -0.1870 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -1.6350 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 6.1730 0.6200 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3350 7.0770 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 6.4080 1.5070 H 0 0 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 36 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 36 1 M END