PUBCHEM-ZINC02671183 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4100 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 1.2950 -0.3760 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.7310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.7950 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -2.2480 -1.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -3.6100 -1.7440 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -3.7980 -3.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -3.4780 -1.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -4.9710 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -5.6570 -1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -6.7240 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -7.1120 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -6.4150 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -5.3530 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -8.2530 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -8.8570 0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -8.6240 2.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -9.7540 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -10.0220 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -9.3280 4.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -11.1240 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -11.3750 6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -12.4100 6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -13.1990 6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -12.9580 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -11.9230 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -14.3080 6.9280 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0580 -14.5240 8.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -15.0050 6.4190 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8930 2.0410 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6590 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.8430 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -1.8390 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.4400 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -1.7490 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -5.3560 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -7.2580 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -6.7100 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -4.8160 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -9.5290 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -10.6350 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -10.7610 6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -12.6050 7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 -13.5780 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -11.7320 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END