PUBCHEM-ZINC06912312 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7080 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1140 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7780 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1370 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7200 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.0520 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.7670 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.1650 -3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.8500 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.8540 -4.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.0860 -5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8090 2.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.0980 2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -4.7830 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -6.2490 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -7.3170 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -8.6090 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -8.8470 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -7.7990 5.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -6.4890 5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -5.2630 5.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -5.1450 6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -4.2500 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.9330 5.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -9.7470 2.2560 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1420 -9.5400 1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -10.8890 2.6770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1880 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.0280 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.2480 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -3.9300 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -1.4700 -5.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.4460 -6.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -2.7580 -6.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -7.1330 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -9.8630 4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -7.9960 6.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -2.5570 5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END