PUBCHEM-ZINC06625899 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.6510 1.2270 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -0.1330 0.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -1.1680 1.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7200 -1.5760 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -2.2300 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -2.1020 -1.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2510 -2.6570 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.6120 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 0.0070 -1.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.5610 -2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.6860 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -0.2390 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 0.2350 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 0.2810 4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -0.1310 4.3950 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.6230 3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.0060 5.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2010 0.0950 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -1.2850 6.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9960 -2.0790 6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -1.0190 8.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2100 -0.9920 8.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 0.3150 8.6380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6310 0.4770 9.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 1.4280 7.7230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2870 1.4400 7.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 1.2120 6.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 2.8120 8.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 3.4630 7.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 0.2370 8.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -0.3320 7.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.1200 8.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -2.3520 8.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -1.5340 6.5950 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2890 1.2010 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.7830 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 1.7270 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -3.2360 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -2.0490 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -2.2500 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -0.2400 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 0.5800 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 0.6510 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.9440 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 3.1680 9.2980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 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 32 33 1 0 0 0 0 M CHG 1 15 1 M CHG 1 34 -1 M CHG 1 45 -1 M END