PUBCHEM-ZINC00404970 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7060 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.2250 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.1010 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.4710 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.9620 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.0880 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.3930 -0.7890 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6640 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.0640 -2.7100 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.4290 -3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -1.0400 -5.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.8460 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -0.4900 -7.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.3280 -7.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.5220 -7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.8830 -5.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.8380 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.7200 4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -3.1510 4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.0290 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.0070 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.0300 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -0.9720 -5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -0.3370 -7.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.0480 -8.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -0.3960 -7.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -1.0390 -5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 M CHG 1 2 1 M END