CHEMBRIDGE-ZINC01056216 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0770 1.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0150 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4680 -0.3650 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.5170 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -2.0200 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -2.7050 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -2.0540 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -3.1670 -0.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -4.5120 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -4.1310 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -5.0700 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -5.3110 2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -5.6670 0.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -6.4920 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -7.2710 2.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -8.0840 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -8.1220 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -7.3480 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -6.5360 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7790 -0.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -5.8750 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -5.8140 0.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -6.0850 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.1860 -0.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -7.4740 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -7.7680 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8050 -9.0850 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -10.0590 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -9.7520 0.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 -8.5150 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -0.5580 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 1.9000 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 1.8700 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.8630 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 0.0060 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.3290 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -2.1970 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.4160 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -5.5260 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -7.2420 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -8.6900 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -8.7580 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 -7.3800 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -5.5710 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 -6.9040 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -5.2220 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -6.5310 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -6.9880 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 -9.3490 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -11.0870 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -8.3040 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -0.0760 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -0.3610 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END