PUBCHEM-ZINC02187198 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.9400 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.5540 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.7960 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -2.4200 4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -3.8060 4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -4.5640 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -3.9390 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -4.7470 1.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8550 -5.9640 1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -4.1960 0.3290 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2990 -4.4390 5.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -3.9230 7.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -4.7760 7.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 -2.5100 6.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.2380 7.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -5.4490 7.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -5.6990 8.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -4.7340 7.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -3.5190 7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -3.2730 7.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -4.9840 8.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -0.7180 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -1.8290 5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -5.6430 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -5.1790 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -6.1990 8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -6.6450 8.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -2.7660 7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -2.3270 6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -5.8330 8.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -4.3090 8.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 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 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END