SIAL-ZINC04523193 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 0.3250 1.2540 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.2210 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.9100 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.2770 1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -3.0340 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -4.2510 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.3180 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.8530 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.9640 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -0.4020 -2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -2.9350 2.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1180 -2.1960 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -3.6350 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -4.9400 3.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9200 -4.8310 4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -5.1860 2.7970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3560 -5.7130 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -3.8890 2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -5.9560 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -5.9640 3.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -5.0640 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.9570 2.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -6.8280 4.1650 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -7.4060 5.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -7.9880 3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -9.1590 3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -10.0270 2.7980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9690 -9.4170 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -11.2430 3.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0240 -10.9940 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -12.0990 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -11.7340 1.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1740 -11.4410 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -10.6000 1.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -12.8090 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -12.8930 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -14.0270 1.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -14.6950 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -13.9500 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -14.2820 -0.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -15.4920 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -16.3270 -0.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -15.9410 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -16.7810 0.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -11.9520 4.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -11.9100 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 1.4770 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.7410 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 1.7050 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -0.4020 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -3.0430 3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -3.7900 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -5.4700 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -6.9900 3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -9.6700 4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -8.8740 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -13.1680 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -11.8000 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -12.1050 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -15.8430 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -16.5010 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -17.6620 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -6.0060 4.7520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 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 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 23 63 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 34 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 45 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 59 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 41 60 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 61 1 0 0 0 0 44 62 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 63 -1 M END