PUBCHEM-ZINC05343529 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.1410 0.7190 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.7530 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.6830 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.0340 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.4600 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.5290 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -1.1720 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.9560 -2.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -4.1480 -2.8400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -4.3280 -4.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -5.1990 -1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -3.5130 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -2.8460 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -2.3480 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -2.5170 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -3.1840 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -3.6860 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 -3.3650 -0.0140 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7150 -3.3060 1.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 -3.5710 -0.0110 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.6160 -1.9730 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 1.0470 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.2770 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 0.8980 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -1.3520 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.7580 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -4.5160 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.4450 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -2.5540 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -2.7140 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -1.8270 -4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -4.2110 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 -2.7620 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -1.6150 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 -1.1490 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END