IFLAB-ZINC02710357 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -0.9070 -1.4110 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.3920 -1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 0.1880 -2.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.2720 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -3.5700 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -4.6410 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.4400 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -3.1280 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -2.0520 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -3.1830 -4.6000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -4.9410 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -5.3600 -3.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -5.7580 -5.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -7.0980 -5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -7.5890 -4.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -7.9700 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -9.3630 -5.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -10.1350 -6.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -9.5100 -7.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -8.1950 -7.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -7.4180 -6.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -12.0220 -6.4230 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -0.6150 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -3.7370 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -5.6450 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -1.0420 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -5.3660 -5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -9.8240 -5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -10.1100 -7.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -6.3450 -6.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 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 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 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 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 M END