PUBCHEM-ZINC06847956 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0650 1.2440 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0060 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -0.5510 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.1570 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4180 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9560 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.1380 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 3.4820 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 4.0760 -0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 4.2480 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 5.6470 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 6.4840 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 5.9790 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 6.8720 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 8.2250 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 8.6720 -0.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 7.8550 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 8.3600 -0.5070 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2360 7.6120 -0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 9.5630 -0.5880 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7520 -0.5340 1.3280 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -2.1380 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -2.8470 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -3.3950 3.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.6630 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -1.5270 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 2.9320 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 1.6690 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 4.0550 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 3.9290 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 4.9160 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 6.5150 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 8.9260 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -1.9810 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -2.7340 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 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 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 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 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 3 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END