PUBCHEM-ZINC00570011 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -2.6940 -0.3850 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -0.5710 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.3030 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.5790 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -1.0520 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -1.2460 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -1.0160 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -1.1140 -2.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -1.8060 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -3.1950 -3.6070 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -1.1760 -4.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -1.5700 -6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -2.6360 -6.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.4960 -7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.9210 -8.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -0.0600 -9.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.5460 -10.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 0.2280 -11.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 1.4970 -11.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 1.9900 -10.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 1.2140 -9.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 0.3030 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.2180 1.9530 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8960 0.6320 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -1.0990 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -0.5880 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -0.3990 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -1.2370 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -1.5320 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -0.6140 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.2820 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -0.3080 -6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 0.4060 -6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -1.5370 -10.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -0.1590 -12.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 2.1030 -12.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 2.9810 -9.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 1.6360 -8.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.1330 3.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 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 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 2 0 0 0 0 M CHG 1 23 -1 M END