PUBCHEM-ZINC03132996 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 -0.1830 1.2330 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.1030 -0.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.7120 -0.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -1.9880 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -2.5250 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -1.7140 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -0.5130 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1150 -2.3240 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 -1.5260 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -2.1010 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 -3.4660 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -4.2620 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -3.7010 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9280 -4.0760 1.0290 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.9260 -3.3760 1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0240 -5.2770 1.2070 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8230 1.6280 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 1.2310 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 1.8570 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.2220 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.5700 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -3.5730 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 -0.4600 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 -1.4840 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -5.3270 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -4.3240 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 8 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 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 26 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