PUBCHEM-ZINC00702068 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.0170 1.4220 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.1030 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -0.6330 -0.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1430 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.1430 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -4.1210 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -4.6090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -2.6120 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -2.1240 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3540 -4.5900 1.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9180 -4.0150 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -4.3340 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 -4.5000 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2460 -3.3690 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6200 -3.5120 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1950 -4.7700 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3900 -5.8940 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0090 -5.7370 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -7.1410 -0.3310 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9530 -7.1200 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 -6.0210 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5120 -6.1970 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -7.4180 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -8.5200 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 -8.3660 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -7.5790 4.7730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -0.3580 -1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 1.8000 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.7090 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8450 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.5260 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.3900 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.6330 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.3520 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -4.4960 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -4.4880 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -4.2580 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 -5.6990 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -2.2460 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4240 -2.2380 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -1.0350 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.4760 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 -3.3170 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -5.0300 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8020 -2.3850 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2500 -2.6340 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2690 -4.8730 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8290 -6.8800 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -5.3420 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -9.4860 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -9.2260 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -0.7640 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -2.6520 0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -4.0820 1.1600 N 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 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 27 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 53 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 6 53 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 54 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 27 52 1 0 0 0 0 M END