PUBCHEM-ZINC00234506 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 0 0 0 0 0 0999 V2000 0.6550 1.7240 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 0.4580 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.1250 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -0.2120 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -1.8760 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.5420 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -4.9060 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -4.5090 -4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -5.7970 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -5.8160 -4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -7.0110 -5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -8.1970 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -8.1960 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -6.9960 -4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -9.4530 -5.6880 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4750 -9.4230 -5.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -10.4670 -5.7280 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8140 2.3610 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 1.4870 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 2.3070 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 0.6670 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -0.1360 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -0.3230 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 1.2100 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 0.2300 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 0.1870 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -1.2910 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -1.9660 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.3450 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0200 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -2.5220 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -4.5490 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -4.8820 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -5.9160 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -4.5960 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -3.7350 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -4.9000 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -6.9960 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -9.1100 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -7.0130 -4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.3840 -1.1690 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6850 -0.2410 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -3.9980 -2.6760 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3350 -4.0550 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 41 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 41 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 43 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 41 1 M CHG 1 43 1 M END