SIAL-ZINC04535990 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 67 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2840 -2.5140 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -2.6900 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.3000 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -1.6620 2.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -2.6520 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -1.8580 -2.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -3.9750 -1.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -4.4540 -3.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8530 -5.5440 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -3.9230 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -4.5120 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -5.7030 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -6.2450 -2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -5.5930 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -4.3980 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -3.8580 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -6.1240 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -3.9630 -3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -3.0130 -3.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -4.5800 -5.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -4.1030 -5.7800 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3040 -3.7450 -5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -2.9600 -6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -1.7660 -5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -0.4110 -6.9280 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 0.8900 -5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -5.2320 -6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -6.3280 -6.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 -5.0250 -7.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -6.1230 -8.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 -5.6320 -9.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2050 -4.4790 -8.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -6.4750 -9.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -2.2640 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -3.7760 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -4.6100 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -4.2050 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -2.8370 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -6.2100 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 -7.1750 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -3.8890 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.9260 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 -5.8310 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -5.3400 -5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -3.2920 -7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -2.6640 -7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -1.4340 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -2.0620 -5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 1.1560 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 0.5280 -5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 1.7680 -6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -4.1490 -7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -6.4800 -8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -6.9370 -7.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2050 -7.3970 -9.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2530 -6.1590 -10.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.6600 2.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -2.3870 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 66 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 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 61 1 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 66 67 1 0 0 0 0 M END