PUBCHEM-ZINC01068271 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -2.2420 -0.1800 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.9170 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -1.5840 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -2.2730 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.2980 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -1.6320 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.9290 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.2340 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.9090 -3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.1650 -5.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.2330 -4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 2.0580 -6.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 3.4330 -5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 4.0060 -4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 3.1930 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 1.8200 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 1.1060 -2.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 4.4200 -7.3760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.8920 -6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.5890 -7.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.8430 -6.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.7130 -7.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.7430 -8.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -3.6350 -9.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -4.5000 -9.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -4.4830 -8.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -3.5890 -7.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -5.6400 -11.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -5.7740 -10.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -4.9100 -12.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -6.9680 -10.6510 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.6990 -7.3380 -9.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.8970 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -0.3890 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -0.4940 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -1.5710 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.7860 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -2.8290 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -1.6510 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -1.9830 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.6270 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 5.0770 -4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 3.6470 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -1.9320 -5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -2.0860 -8.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -3.6520 -10.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -5.1570 -8.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -3.5890 -6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 19 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 31 -1 M END