PUBCHEM-ZINC04097657 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3750 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.6980 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 0.0310 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0890 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.4490 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 2.1090 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -2.0510 -0.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9840 -2.9340 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -4.3630 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -5.2640 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -4.8600 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 -5.3670 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3780 -4.7270 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -6.7360 -1.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -7.3400 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -6.7460 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -8.7340 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -9.3550 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -5.3090 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -6.3110 -1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -2.3750 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6580 -2.9440 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -3.1540 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -3.1380 -2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9000 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -0.4910 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.8390 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 2.3140 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -2.6100 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.6880 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -3.7750 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -5.3130 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -7.2220 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -6.8940 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.9090 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -0.9020 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -9.3120 -2.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 -4.1440 -1.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -3.8660 -1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -4.3490 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 -4.1560 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -10.2220 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 40 45 1 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 9 1 M END