PUBCHEM-ZINC06378708 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1580 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4570 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8370 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.6130 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.8290 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -3.9830 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -4.4230 1.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5390 -3.5840 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -2.5770 1.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -1.8250 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -3.7460 3.6680 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -5.5690 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -6.4870 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -7.6320 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -7.8690 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -6.9610 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -5.8100 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.2360 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.1440 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3090 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -3.6900 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -4.4640 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -4.4940 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -6.3040 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -8.3450 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -8.7670 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -7.1510 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -5.0990 -0.1600 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 30 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 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 11 1 M END