PUBCHEM-ZINC03125013 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -1.5140 1.9340 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 0.4300 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.1670 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -0.2460 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -1.5870 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -2.4150 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -3.7820 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -4.3350 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -3.4890 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -2.1250 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -4.0110 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -4.1960 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -3.8260 -1.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -4.8630 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -5.7810 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -6.5020 0.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -6.3740 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -7.8870 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -8.4800 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -8.5910 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 -9.1350 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -9.5690 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -9.4590 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -8.9190 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -10.1510 1.0730 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7800 -10.2480 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 -10.5340 0.0540 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9030 -4.5880 0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -4.9030 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -4.3980 2.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -5.8850 1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 2.3020 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 2.3520 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 2.2360 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -1.9880 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -1.4740 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -5.1240 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -5.7680 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -4.1810 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -6.1700 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -5.9300 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -8.0910 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -8.3310 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -8.2520 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 -9.2210 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -9.7980 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -8.8360 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -6.2300 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 -6.7360 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -5.3990 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END