CHEMBRIDGE-ZINC04983631 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0700 1.0660 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.2650 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -0.8730 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -0.1460 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 1.1910 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.7930 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -0.7590 -0.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -0.0610 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 1.1210 -1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 -0.7320 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -2.0920 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 -2.7150 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -1.9930 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -0.6390 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 -0.0110 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6940 0.1250 -0.6870 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7620 1.2730 -0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 -0.3940 -1.2140 O 0 5 0 0 0 0 0 0 0 0 0 0 9.7040 -2.6250 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7600 -4.0790 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1940 -4.5100 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7660 -4.5690 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0880 -4.9710 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7880 -5.2970 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2120 -5.2280 -0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9550 -4.8560 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 1.5410 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -0.8300 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -1.9130 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 1.7590 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 2.8320 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -1.6860 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -2.6530 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3340 -3.7650 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 1.0380 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5230 -2.1050 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1900 -4.3580 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3340 -4.5680 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1940 -4.3090 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5650 -5.0290 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8190 -5.6100 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5160 -4.8160 -1.7790 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 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 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 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 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 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END