IBS-ZINC05451661 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1410 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4790 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -1.8560 3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6270 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0010 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.1030 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -4.7940 3.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -6.1020 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -6.5780 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -5.2090 1.0450 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -7.0100 4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 -6.6400 4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -7.5240 5.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -7.3820 5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 -6.5200 5.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -8.2630 6.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8230 -8.1210 6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4310 -9.0070 7.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6620 -9.9990 8.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 -10.8280 9.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5740 -10.6840 9.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3470 -9.6970 9.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 -8.8660 8.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6160 -9.7650 9.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 -11.0600 10.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3590 -11.3660 10.7050 O 0 0 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 1.1630 1.2190 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1170 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -2.3370 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5920 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -7.6210 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -6.8970 5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -8.0450 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -6.7540 3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 -5.6060 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -8.2110 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -9.0280 7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4180 -7.3560 6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -10.1140 8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 -11.5930 9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 -8.1040 7.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 -11.7970 9.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3550 -11.0150 11.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 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 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END