PUBCHEM-ZINC06211992 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -4.8060 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3640 -6.3420 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -6.8230 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -6.3600 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -5.1320 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -4.6600 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -5.4100 -2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -6.6240 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -7.0990 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -8.3990 -0.7220 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9090 -9.0490 -1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -8.8190 0.1360 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.2220 -4.9070 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -4.3560 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -3.4080 -1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -4.2960 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -4.7970 1.2340 O 0 0 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -6.6970 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -6.7070 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -3.7130 -3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -7.2050 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -5.2650 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2260 -5.2760 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -3.8170 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -4.6410 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -3.2060 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -4.5130 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END