ASINEX-ZINC00846727 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -5.6310 -1.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1670 -5.4210 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -5.3290 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 -6.0800 -2.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9310 -5.6180 -1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -4.4220 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 -4.2230 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4290 -5.2070 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1660 -6.3980 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -6.6120 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3240 -7.7390 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -7.3520 -2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -8.2280 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -9.4600 -3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -9.8410 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8010 -8.9900 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 -11.5360 -3.9180 Br 0 0 0 0 0 0 0 0 0 0 0 0 -11.1230 -4.9130 0.4680 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -7.0080 -1.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -3.7040 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.9640 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -4.2620 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -5.6220 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -3.6500 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6670 -3.2930 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9270 -7.1640 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -7.9420 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -10.1360 -4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -9.2870 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -7.2670 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 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 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 31 50 1 0 0 0 0 M END