PUBCHEM-ZINC06187632 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.3700 0.7020 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.1150 0.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6660 -0.6140 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -0.7210 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -0.7290 0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -2.5430 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -1.4600 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -1.4750 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -2.2200 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -2.9710 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -2.9710 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -2.2130 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -2.1340 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -2.8090 3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -1.4160 1.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 1.1290 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 0.9060 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 1.3950 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 1.2020 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 1.6680 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 1.4910 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7560 1.9410 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 2.2780 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 3.1540 2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 2.4850 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 1.8710 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 2.1160 1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 2.9920 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 3.6420 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 3.3990 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 3.2270 0.6350 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 1.2990 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -0.1000 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 1.3380 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -0.8910 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 -2.2080 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -3.5530 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -3.5560 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 1.4260 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -0.1620 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 0.8510 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 2.4550 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 1.7620 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 0.1430 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 1.0970 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 2.7240 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 2.0670 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 0.4370 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 1.3380 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6630 3.0000 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 1.2050 2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 1.6350 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 4.3360 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 3.9170 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 1.7690 0.6150 N 0 3 0 0 0 0 0 0 0 0 0 0 9.8430 2.0580 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2450 0.7870 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 2.3330 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 15 2 0 0 0 0 5 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 55 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 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 55 1 M END