CHEMSTAR-ZINC04018283 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.7490 3.0210 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.6040 0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 0.8010 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 1.2660 0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.6820 0.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8290 -1.0930 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.9300 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.4020 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -3.2280 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -4.5790 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -5.1020 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -4.2750 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -2.9240 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -1.3320 0.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -1.6940 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -1.4820 2.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -2.3640 1.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3810 -1.7020 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -3.6690 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -4.4890 1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -2.6550 2.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -2.7760 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4710 -2.5050 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8310 -2.6260 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -3.0150 3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 -3.2860 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0780 -3.1730 4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -3.4700 5.2380 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0830 -4.0290 5.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -3.1540 6.3790 O 0 5 0 0 0 0 0 0 0 0 0 0 -10.7740 -3.1430 3.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.5470 -2.9040 2.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2020 -3.4860 4.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1960 3.5550 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 3.4030 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 3.1690 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -0.5990 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -0.3730 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -2.8200 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -5.2250 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -6.1570 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -4.6840 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -2.2770 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -1.5020 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 -4.1960 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -3.4450 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -5.3340 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -2.7640 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -2.2000 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5180 -2.4150 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8210 -3.5900 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 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 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 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 19 1 0 0 0 0 17 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M CHG 1 31 1 M CHG 1 33 -1 M END