PUBCHEM-ZINC06059880 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 2.1780 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6280 3.3960 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 1.5860 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -2.0600 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -2.6240 -0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5160 -2.2140 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 -4.1480 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -6.1440 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 -6.6490 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -6.2240 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 -4.6990 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -4.2500 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 -2.2640 -1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -2.4080 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.3990 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -4.4230 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -4.5640 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -6.4330 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -6.5810 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 -7.7360 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2290 -6.2230 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -6.6810 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4680 -6.5440 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8340 -4.3930 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8910 -4.2420 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 -4.6970 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -3.1640 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -2.5960 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2640 -4.6800 0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 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 12 20 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 40 1 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END