SIAL-ZINC04545855 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0350 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -2.7320 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.6030 -1.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -4.0620 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -4.4370 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -3.5700 -3.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -5.7350 -3.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -6.0990 -4.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1380 -5.3750 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -7.4930 -4.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -7.4580 -4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -6.4260 -3.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -6.1040 -5.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -5.8310 -4.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.1620 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.5860 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -1.2750 2.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2030 3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 3.5200 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 4.2240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 3.5530 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -2.0460 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -4.4700 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -4.4690 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -6.4280 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -8.2020 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -7.8010 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 0.3900 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 0.8820 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -0.5810 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.5430 5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 3.9940 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 2.5830 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 4.0490 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -8.5750 -4.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -6.4110 -6.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -0.7850 4.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.7860 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 5.5270 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 6.0000 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -6.4010 -7.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -8.5040 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 50 2 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 40 48 1 0 0 0 0 46 53 1 0 0 0 0 47 52 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M END