PUBCHEM-ZINC00645235 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.8030 1.2960 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.1900 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -0.8270 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.2040 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -2.9500 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.3260 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.9480 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -4.6860 -0.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -5.0440 -1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -4.9170 1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -5.4030 0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -5.5830 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -4.6350 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -4.7200 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -4.5090 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -5.4570 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -3.6240 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -2.4430 0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -4.0870 0.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6700 -3.3150 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -1.9150 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 -1.1940 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0640 -1.8600 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0760 -3.2510 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 -3.9990 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9590 -5.5100 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -6.1250 1.2480 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1520 1.8000 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 1.5720 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 1.6590 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -0.2510 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -2.6810 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -2.8970 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.4670 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -5.4380 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -6.6230 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -3.6090 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -4.8620 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -5.7090 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -3.4740 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -4.6450 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -6.4890 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -5.2250 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -5.1100 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 -1.3490 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8490 -0.1090 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9880 -1.3020 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0200 -3.7650 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0920 -6.0460 1.6060 O 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 17 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 42 1 0 0 0 0 16 43 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 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 2 0 0 0 0 M CHG 1 27 -1 M END