PUBCHEM-ZINC05499981 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 48 0 0 1 0 0 0 0 0999 V2000 0.1050 1.5240 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.0080 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.5080 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7080 -2.0160 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.7280 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -4.0610 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -4.7720 -1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -4.1880 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -4.8150 -0.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -2.6960 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -2.0190 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -0.6450 -1.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 0.0280 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.0700 -2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -6.2190 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -6.2900 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -5.0130 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -4.7290 -2.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -5.7950 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -5.5980 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -6.6670 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -7.9750 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -8.2110 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -7.1390 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -7.3780 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 -6.4230 -3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -5.2170 -3.1550 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1590 0.0000 -2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.0280 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.9070 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.8020 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.3260 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -0.4200 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.1680 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -2.0330 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.5280 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -6.6710 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -6.6420 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -4.5780 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -8.8180 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -9.2380 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -8.3870 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 0.8590 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1290 -7.4500 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 44 2 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 27 -1 M END