ACROSORGANICS-ZINC04261917 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 -0.2080 1.0120 -0.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -0.1080 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 0.0300 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.6110 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 1.2570 1.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 1.6840 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 1.8090 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 2.7880 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.2280 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -1.4320 -1.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2750 -1.7480 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -2.4550 -1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.0910 -2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -3.7500 -1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -4.7900 -1.5670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0230 -4.4040 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -6.0730 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -5.9440 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -7.3010 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -7.2170 -5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -5.0950 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -5.2990 0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 -5.0940 0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -5.3270 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 -5.1730 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1470 -4.9480 0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -2.1550 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -1.0220 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -4.0250 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -6.3750 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -6.8850 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -5.5680 -4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -5.2170 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -7.6730 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -8.0280 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -6.8500 -6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -6.5930 -6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -4.9190 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -6.3400 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -4.6100 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -8.5750 -6.5560 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3150 -8.5560 -7.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -9.2150 -6.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -8.9950 -6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -5.2880 3.0310 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5590 -0.1140 -2.2680 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.1000 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 0.6450 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 0.0760 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 2 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 41 1 M CHG 1 45 -1 M CHG 1 46 1 M END