KEYORGANICS-ZINC04054710 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.7550 -0.7200 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -1.5440 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.9320 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -0.8080 -0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -0.1740 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 1.1780 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 1.8140 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 1.1040 -3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -0.2370 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.8690 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -0.7300 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -0.8130 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -0.6710 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -0.4650 3.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.4250 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -0.5460 2.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -0.8140 2.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -1.2490 3.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0170 -0.7740 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 -2.7800 3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -3.4400 4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -3.3640 5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -3.9490 5.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -4.6140 4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -4.6980 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -4.1170 3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9390 -0.8150 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2830 -0.4890 2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -1.2290 0.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4020 -2.3950 -0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -0.4030 -0.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7140 -1.2020 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 0.2850 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.6150 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.7300 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.8850 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -3.4970 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -3.5030 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 1.7510 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 2.8610 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 1.5930 -4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -0.7980 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.9260 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -0.2790 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4480 -0.5630 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1880 -3.0810 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -3.2030 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -2.8380 6.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -3.8820 6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -5.0640 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -5.2110 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -4.1830 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6190 -0.8410 4.7130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M CHG 1 53 -1 M END