PUBCHEM-ZINC02045136 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 1 0 0 0 0 0999 V2000 0.0940 1.5640 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.0290 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.4070 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -0.5410 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3540 -1.6380 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -0.0130 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 1.0450 -0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -1.1050 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -0.5770 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -1.5590 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -2.7050 2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -0.9790 4.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 -1.8230 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -0.7510 -1.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 0.2510 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -0.3860 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 0.4090 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 1.4370 -1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 -0.1940 -3.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9490 0.4800 -3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.9670 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 1.9180 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.0230 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.0290 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.4970 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -0.0810 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -2.0550 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -1.3010 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.4030 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 0.3660 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7020 -1.2580 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6950 -2.1120 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -2.7070 4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.2630 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 0.3130 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -1.4020 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -0.4210 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 1.4880 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4740 0.5160 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 -0.0850 -4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -0.7170 -2.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1580 -0.1280 1.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 0.7440 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 42 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 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 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 41 -1 M END