IBS-ZINC02346340 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3810 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.7040 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -1.9960 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -0.9720 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 0.3460 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.6450 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -1.2940 -5.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2940 -2.3150 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -1.1250 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.5080 -6.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.7610 -8.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.8200 -8.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 0.0310 -8.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -0.1260 -7.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 0.3200 -6.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 1.1750 -6.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -0.3510 -5.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -0.1690 -4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -1.1180 -4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -0.9310 -3.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5550 -1.6860 -2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6310 -1.5140 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -0.5890 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 0.1640 -3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 -0.0100 -4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -2.5340 -6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -3.7020 -7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -4.6550 -6.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -4.4570 -5.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -3.3030 -4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.3390 -5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -1.2080 -4.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.5040 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -3.0240 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 1.1430 -4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.6750 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 0.8610 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -0.3880 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -2.1480 -4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5950 -0.9000 -5.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -2.4080 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 -2.1030 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4520 -0.4550 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2840 0.8880 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3720 0.5760 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -3.8590 -8.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -5.5590 -7.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -5.2080 -5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -3.1540 -3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -0.4830 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 34 55 1 0 0 0 0 M END