PUBCHEM-ZINC03870382 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.2000 1.6900 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 0.1700 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -0.5080 0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0840 -0.0770 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -0.1840 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 0.9030 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -2.0500 0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1230 -2.5100 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -2.4770 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -3.9570 1.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.7060 2.5930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -6.1400 2.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -4.1120 2.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.2250 4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -4.7960 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -4.5130 5.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -3.6610 6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -3.0790 6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -3.3660 4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -3.3940 8.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6200 -4.0820 8.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -2.5040 8.6860 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8290 -2.6730 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -2.1120 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 2.1040 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 2.0110 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 2.1240 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.2340 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.0480 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.9600 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -2.1760 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -2.0260 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -4.2370 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -5.4670 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -4.9700 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.4200 6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.9320 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -3.7130 1.3030 O 0 5 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 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 38 -1 M END