CHEMDIV-ZINC01073109 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.6790 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5980 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -3.7680 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.3960 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 -4.4640 0.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -5.4580 1.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 -3.3700 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -5.2640 -1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -6.4360 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -7.1980 -2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -8.4040 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -9.6340 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -10.4700 -3.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -11.4080 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -9.7810 -4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -8.4590 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -7.5230 -4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -7.9030 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -9.2100 -5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -10.1420 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -6.6400 -6.9040 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -10.0330 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -5.9480 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -6.7420 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -8.2250 -0.0320 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2530 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -4.6970 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.7500 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -4.9560 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -6.1140 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -7.0880 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -7.5200 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -6.5470 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -6.5060 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -9.4960 -6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -11.1560 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -10.3820 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -10.8340 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -9.1740 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -6.5120 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -6.5220 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -8.8310 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -8.4560 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -8.4450 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 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 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 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 22 23 1 0 0 0 0 22 44 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 45 1 0 0 0 0 25 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END