PUBCHEM-ZINC00634076 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.2640 1.3270 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -0.1920 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -0.7100 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -1.0060 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -1.4730 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -1.6210 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -1.3370 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.8690 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -1.6210 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -2.0590 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -2.0570 0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -2.4870 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -2.5210 3.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 -2.8560 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8960 -3.3080 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8570 -3.6560 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8820 -4.9550 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7440 -5.2700 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5800 -4.2790 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5600 -2.9790 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6960 -2.6700 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6850 -4.6850 -2.0930 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.8300 -3.4060 -2.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9240 -5.6900 -2.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.0180 -5.2240 -1.4130 N 0 5 0 0 0 0 0 0 0 0 0 0 -14.4110 -4.4490 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -1.4800 3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 1.6740 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 1.6940 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 1.7840 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.6230 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -0.5330 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -0.8730 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -1.7050 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -0.6320 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -2.8030 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7090 -4.1750 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3050 -2.5190 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2250 -5.7250 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7620 -6.2760 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2080 -2.2140 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6750 -1.6540 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -0.7710 4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -2.4460 4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -1.1150 3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 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 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M CHG 1 25 -1 M END