PUBCHEM-ZINC02164771 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0280 1.3150 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.0060 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7720 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -1.6960 -1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -2.4990 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -2.4580 -0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -3.3480 -2.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -4.2510 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -3.8820 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 -4.7740 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -6.0340 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -6.4040 -3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -5.5140 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -7.7540 -3.7340 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9670 -8.5370 -3.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -8.0800 -4.0680 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8970 1.8730 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 1.8380 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -0.5170 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -1.3380 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -0.0830 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -1.7280 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -3.3340 -3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -2.8990 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -4.4880 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -6.7310 -2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -5.8020 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 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 23 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 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END