CHEMDIV-ZINC04787755 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -2.6680 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.5410 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1020 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -1.6130 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -2.3580 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -3.4010 -0.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -4.3260 -0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -3.5030 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 -3.5060 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 -2.7350 -1.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6050 -4.5820 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9470 -4.4820 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -5.7770 -4.6060 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.1230 -5.5220 -5.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1340 -7.0600 -4.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6260 -5.5410 -5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8700 -4.7610 -6.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1910 -4.7320 -6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0210 -5.4890 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1210 -6.3040 -4.8260 S 0 0 0 0 0 0 0 0 0 0 0 0 -15.8790 -5.6650 -6.4030 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -3.7480 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0350 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 1.1810 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -0.9100 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 -1.0690 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -2.8180 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1500 -1.6600 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -4.9740 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -4.9290 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -2.9330 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -4.1720 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7930 -4.4540 -3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5210 -5.5600 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7590 -4.6100 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0320 -3.5030 -3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0940 -4.1940 -6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5250 -4.1410 -7.6580 H 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 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 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END