PUBCHEM-ZINC06761371 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.3480 1.7490 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.2770 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.1810 -0.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.5240 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -1.9830 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1760 -2.2060 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -2.6780 -1.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6910 -3.7480 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -2.5310 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -2.8340 -1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4130 -2.1360 -0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -2.5570 0.6760 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2170 -3.6480 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -2.1580 2.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2090 -1.1800 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -3.2080 2.7160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1770 -4.1780 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -2.7820 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -3.7000 4.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -3.9110 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -3.4300 1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -3.9270 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -2.0690 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -1.2660 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -2.3010 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -2.3290 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -1.2410 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -4.3560 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -5.1380 -2.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -2.2110 -2.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.5610 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 2.2950 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 2.0690 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 1.9790 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -0.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -1.4960 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -3.1540 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -2.7780 4.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -1.7900 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -1.2630 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -2.8700 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 -3.2990 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 -1.3300 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -0.2500 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -4.6250 -0.1040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 45 -1 M END