SIAL-ZINC05274073 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 72 0 0 1 0 0 0 0 0999 V2000 -0.6820 2.2700 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 0.7580 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 0.3960 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 0.0360 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -1.4740 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9140 -1.7870 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -2.1920 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -2.9070 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -2.0380 1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -2.7350 1.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8570 -3.7100 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -1.9080 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -1.8270 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -1.0000 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5330 -0.9190 -3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -2.9190 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -2.5080 3.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -3.5400 3.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6950 -3.8090 4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 -3.7840 4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2680 -4.0500 6.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 -4.3410 7.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -4.3680 6.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -4.1080 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5190 -4.6260 8.5270 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.6670 -4.6020 8.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 -4.8820 9.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9430 -1.8040 -1.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -1.7220 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -1.3750 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.0600 -2.7740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5440 -2.9290 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.8700 -3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -1.2140 -5.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -0.5560 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 2.7850 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 2.5280 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 2.5740 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.4540 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.7000 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.6810 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 0.9110 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 0.2710 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 0.3620 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -1.4660 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -2.3820 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -0.9040 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -1.3530 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -2.8320 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -1.4740 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 0.0040 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -0.4450 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 -1.9230 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6560 0.7900 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0600 -3.8010 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8130 -3.5560 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2850 -4.0300 6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 -4.5950 7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -4.1330 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -2.0800 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -0.0010 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.0830 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -0.3660 -5.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -1.4370 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.3110 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 0.2920 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.4250 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.6540 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5800 -0.1250 -3.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4120 -0.0560 -4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -2.3620 -2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -1.5710 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 15 69 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 27 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 71 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 54 69 1 0 0 0 0 68 71 1 0 0 0 0 69 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END