CHEMDIV-ZINC06950113 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 3.0860 1.1580 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -0.2410 1.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -0.6470 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 0.0640 1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -2.0930 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -2.6740 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -4.0470 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -4.8560 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -4.2700 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -2.8980 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -6.2490 0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -7.0280 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -6.6640 -0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -8.5070 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -10.6970 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -11.3730 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -11.1380 -2.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -9.7380 -3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -9.0840 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -12.1240 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -11.8660 -5.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -13.4390 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -14.6570 -4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -15.6080 -3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -14.9130 -2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -13.5990 -2.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 1.4350 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 1.3710 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 1.7420 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -2.0640 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -4.4450 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -4.8680 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -2.4780 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -6.7050 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -8.6670 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -8.9360 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -10.7370 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -11.1720 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -12.4380 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -10.9780 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -9.6400 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -9.2190 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -9.5630 -2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -8.0140 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -14.8280 -5.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -16.6650 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -15.1920 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -9.2390 -0.9890 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8830 -8.7490 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END