CHEMBRIDGE-ZINC00311490 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -3.0060 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -3.9860 2.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -3.7290 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -2.6190 3.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -2.1960 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -4.5520 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -4.1620 5.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -4.9310 6.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -6.0870 6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -6.4790 5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -5.7140 4.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -6.9080 8.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5470 -6.5660 9.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -7.9270 8.1580 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -2.4300 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -3.8060 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.3060 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -3.2600 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.6290 7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -7.3830 5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -6.0190 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 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 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END