PUBCHEM-ZINC01846982 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 0 0 0 0 0 0999 V2000 1.0600 1.9430 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.4660 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.4120 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.8980 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -2.3140 -1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.6690 1.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -4.0780 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -4.6440 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.0330 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -6.8740 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -6.3190 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -4.9280 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -8.3360 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -8.7980 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -9.1290 0.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -10.5740 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -11.1730 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -12.9730 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -14.3130 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -13.3840 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -13.6240 -1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 2.2020 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 2.5530 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 2.2100 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 0.2460 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 0.2380 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -0.2000 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -0.1930 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.1670 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -4.0160 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -6.4490 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -6.9370 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -4.5380 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -8.7100 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -10.9690 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -10.8220 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -10.7310 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -11.0090 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -12.9430 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -12.1830 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -14.3240 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -14.5050 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -15.1410 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -12.7700 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -14.3460 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -14.1680 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -12.6900 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -14.2250 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -12.6770 0.5430 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5400 -13.0570 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 49 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 49 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END