SIAL-ZINC04517756 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 1.8580 1.0720 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -0.3050 -1.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -0.6690 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.0850 -1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -2.1750 -1.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1490 -2.6930 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -2.5830 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -4.0810 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -4.7460 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -6.1300 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -6.8450 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -6.2090 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -4.8250 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -8.2400 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -8.7300 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -8.0640 1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -10.2400 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -10.8730 2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -12.3680 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -13.0580 1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -12.8220 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -14.2030 3.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7710 -14.5780 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -15.0400 3.8610 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9270 -14.8190 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -14.6580 5.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0480 -13.6920 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -15.6890 6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -17.0150 5.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -17.4960 4.2480 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -17.1610 3.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -16.4070 3.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -14.4330 6.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -14.3500 5.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3450 -15.2860 5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -13.2750 5.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -12.4750 6.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -11.5740 6.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -11.8070 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -12.8740 4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -13.3840 3.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -12.7050 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -11.6460 3.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -11.1760 4.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -10.0970 5.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 1.7170 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 1.3000 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 1.2530 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -2.1240 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.1850 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -4.1880 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -6.6370 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -6.7820 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -4.3300 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -10.5590 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -10.5600 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -10.4540 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -10.6690 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -15.5080 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -15.6250 5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -12.5880 7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -13.0500 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -9.7500 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -9.6760 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -18.8700 4.1830 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3700 -2.5200 -0.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -2.1200 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -3.5330 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 66 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 53 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 30 65 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 40 1 0 0 0 0 37 38 2 0 0 0 0 37 61 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 44 2 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 42 62 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 63 1 0 0 0 0 45 64 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 M CHG 1 65 -1 M END