PUBCHEM-ZINC04215810 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.4630 1.5850 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 0.0730 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -0.3420 1.5910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0410 -1.2190 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -0.8180 1.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -0.4910 -0.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6010 0.4900 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.6730 -1.1470 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -1.7100 -0.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1270 -1.4640 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -1.6700 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -2.2560 2.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -2.9380 -0.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -4.0300 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -4.0560 -0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -5.2420 -1.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6870 -5.2680 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -5.0990 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -4.8400 -3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -4.6610 -5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -4.7580 -6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -5.0120 -5.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -5.2330 -4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 0.7590 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 1.4950 2.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -0.5270 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 2.0490 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 1.8060 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 2.0900 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -2.9670 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.7410 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -5.4200 -5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -3.6790 -5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -4.6140 -7.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -5.0700 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -4.5070 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -6.2340 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -0.2870 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -1.6180 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -0.1320 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -6.4840 -1.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -6.5600 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -6.3520 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 0.8160 3.4420 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 24 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 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 18 1 0 0 0 0 16 41 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 44 -1 M END