PUBCHEM-ZINC00570115 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.1700 1.3120 1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -0.0710 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -1.0690 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -2.3640 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -2.6750 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -1.6850 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -0.3790 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 0.6590 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -4.0380 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -4.1570 -1.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -5.0780 0.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -6.4710 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -7.1790 -0.8060 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -8.4120 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -8.8760 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -10.1180 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -10.9290 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -10.4510 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -9.2070 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -12.2720 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -12.6290 4.2800 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8540 1.6190 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 2.0270 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 1.3580 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.8400 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -3.0990 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -1.9340 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.0060 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 0.2570 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.5090 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -4.8010 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -8.2870 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -10.4560 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -11.0520 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -8.8840 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -12.9410 3.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -7.1310 1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -6.6240 1.3560 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 28 1 0 0 0 0 8 29 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 2 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 21 -1 M END