PUBCHEM-ZINC06512033 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7220 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.4390 0.7540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.1460 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.7790 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3480 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.8380 -2.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.2820 -3.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -1.0060 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.6150 -3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.0270 -2.0170 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0450 -4.4950 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -5.0310 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -3.7880 -4.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2520 -3.7710 -5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -4.3040 -4.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -4.7530 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -4.0850 -5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -4.3900 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 -4.0200 -7.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -3.3470 -8.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -3.0400 -7.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -3.4040 -6.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -3.2400 -6.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -6.1840 -3.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1420 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -4.8240 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -4.8480 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -4.9140 -5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -4.2570 -7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -3.0640 -9.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -2.5160 -8.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -3.7510 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.0160 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -0.8160 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.8270 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 26 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 12 1 M END