SIAL-ZINC04543441 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3160 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -0.6770 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0490 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.4530 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 2.0380 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.8980 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 0.8000 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -0.2830 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 3.2960 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3230 3.9010 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 3.8270 1.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4120 4.6870 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 4.2420 1.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6820 5.2940 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 3.3170 0.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2430 2.2940 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 3.3960 -0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 3.7980 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 3.5700 1.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 4.0750 2.9790 P 0 0 3 0 0 0 0 0 0 0 0 0 8.1070 5.4910 3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 3.9280 2.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 2.7790 2.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 2.6780 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 3.4400 2.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 1.6140 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.7160 3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.6520 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.1100 5.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.0660 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.7460 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -2.1460 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -4.2530 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -4.7720 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -6.2790 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -6.8770 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.8230 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 0.8260 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1040 3.2320 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 4.8610 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.6310 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 1.7550 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 2.6990 4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.5750 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -2.5460 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -4.6090 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -4.6180 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -4.4160 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -4.4070 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 3.1610 4.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 0.5510 5.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -6.9570 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -7.9220 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.1480 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 3.1780 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 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 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 31 32 1 0 0 0 0 31 46 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 47 1 0 0 0 0 34 48 1 0 0 0 0 35 36 1 0 0 0 0 35 49 1 0 0 0 0 35 50 1 0 0 0 0 36 37 2 0 0 0 0 36 53 1 0 0 0 0 51 56 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END