PUBCHEM-ZINC03872733 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 1 0 0 0 0 0999 V2000 0.6000 1.3200 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -0.1840 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -0.5260 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 0.3410 0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -1.8750 0.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -2.4740 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3150 -1.8050 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -2.8400 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -1.4010 -2.6910 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.2700 -2.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.2840 -3.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -3.7800 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -4.3720 1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -4.2540 0.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -5.5190 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -5.8650 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4710 -4.9780 0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.9290 -0.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7450 1.3940 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 3.4270 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 4.1290 -0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8600 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 1.4750 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.7170 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.5600 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.5270 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -3.4680 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -3.4560 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 -3.7700 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -6.3110 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -5.4300 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3230 -6.9700 1.2320 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2800 3.7250 0.7590 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2570 1.8830 -1.0480 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4080 2.9210 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 1.4810 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 1.4290 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 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 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 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 9 10 1 0 0 0 0 10 11 2 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 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 M CHG 1 32 -1 M CHG 1 33 -1 M CHG 1 34 1 M END