CHEMDIV-ZINC00853022 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 -0.0780 2.8590 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 1.5000 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.6900 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 1.1460 1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 2.4740 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 3.3510 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 2.9370 1.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 4.2450 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 5.2750 1.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 4.2520 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 5.3050 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 5.0070 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 3.6750 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 2.6230 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 2.9490 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 2.1060 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 0.9080 0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 3.4420 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8020 4.1910 -0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1540 2.3630 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2470 1.8960 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0850 0.9130 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8510 0.3840 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7520 0.8660 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 1.8530 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7670 -0.6690 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7820 -1.0030 1.4630 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8680 3.5400 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.0880 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.3840 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 4.4200 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 6.3240 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 5.8090 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 1.5970 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4590 2.2970 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9350 0.5590 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5560 0.4760 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0990 2.2180 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4510 -1.1360 3.2900 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 16 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 2 0 0 0 0 M CHG 1 27 -1 M END