ACROSORGANICS-ZINC02244127 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 -0.8050 0.8080 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.0600 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 0.7270 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -1.2370 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.6780 -0.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 0.0750 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 1.2940 -1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 -0.7530 -1.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -0.3330 -2.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6820 0.5970 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -0.1660 -3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 1.0090 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 2.3100 -4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 3.4020 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 3.2050 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9130 -5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 0.8170 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.6460 -5.6030 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -1.4200 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -2.5920 -2.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.6970 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 0.2490 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 1.1490 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.0530 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 0.1170 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.6220 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -1.8470 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -1.9030 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.8960 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -1.7580 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 -0.0360 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -1.0840 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 2.4780 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 4.4060 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 4.0610 -5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -0.1860 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 -1.0090 -2.3180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 M CHG 1 37 -1 M END