PUBCHEM-ZINC06636341 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -1.6500 1.4620 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.0290 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.4760 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -1.8830 2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.4850 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -1.8550 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -2.5900 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -3.9600 3.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -4.5940 3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -3.8570 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -6.0470 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -6.4150 1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -6.8430 4.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -8.2440 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -9.3420 2.9540 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -8.5510 5.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -9.7090 6.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -9.8720 7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -10.9620 8.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -11.9010 7.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -11.7530 6.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -10.6420 6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -12.7100 6.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -13.9450 6.6470 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8790 -13.1680 9.1520 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 2.0400 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 1.7540 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 1.7350 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -0.5880 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.2860 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 0.0540 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -0.2560 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.7910 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -2.0870 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -4.5030 4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -4.3510 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -6.3490 4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -7.8530 5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -9.1610 7.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -11.0650 8.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -10.5180 5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -12.1890 6.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 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 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 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 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 2 0 0 0 0 M CHG 1 24 -1 M END