SIAL-ZINC04535766 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 -0.0880 4.0480 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 2.7150 -0.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7230 2.9020 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 1.9270 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.8360 1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 2.4340 1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 1.6680 1.9190 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1860 0.6050 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 2.1030 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 1.7150 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 2.5940 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 2.2390 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 1.0030 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 0.1230 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 0.4820 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 0.5560 -3.9420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 1.9210 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 2.8480 3.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 1.1170 4.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 0.0100 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -0.6370 5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -0.2170 6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 1.2080 5.7650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7980 1.9340 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 1.5830 5.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.2140 5.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 2.3290 7.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.9520 -0.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 2.1720 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 3.0000 -2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 1.3880 -1.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8500 0.3510 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 1.9950 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 1.1410 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 0.1020 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 -0.6830 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 -0.4290 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4230 0.6140 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 1.3990 -1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7490 -1.2000 -1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 0.8650 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 4.6150 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 4.6180 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 3.8610 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 3.3060 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 3.1840 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 1.6120 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 3.5590 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 2.9260 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 -0.8420 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -0.2030 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -0.7250 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 0.3910 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -1.7220 5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -0.2380 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -0.8820 6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -0.1850 7.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 2.6240 7.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 2.5710 7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 1.2900 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 2.0410 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 3.0020 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -0.0950 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -1.4940 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 0.8130 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 2.2140 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5030 -0.8740 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 1.4360 -3.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 2.3870 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 68 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 65 1 0 0 0 0 39 66 1 0 0 0 0 40 67 1 0 0 0 0 41 68 1 0 0 0 0 68 69 1 0 0 0 0 M END