ACROSORGANICS-ZINC02554978 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.7640 1.0170 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.0380 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 0.7070 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -1.1190 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -0.5910 -0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 0.1450 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.3530 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -0.6840 -1.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -0.2680 -2.2990 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6940 0.6210 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -0.0050 -3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 1.1720 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 2.4840 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 3.5460 -4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 3.2560 -4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 2.0040 -5.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 0.9940 -4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -1.3950 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -2.5630 -2.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.8990 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 0.5440 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 1.3690 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.0380 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 0.0170 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 1.5850 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -1.6470 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -1.8620 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.7680 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -1.6850 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 0.1740 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -0.9010 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 2.6810 -3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 4.5720 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 4.0510 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 0.0000 -4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -1.0150 -2.2640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 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 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 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 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 M CHG 1 36 -1 M END