PUBCHEM-ZINC05791178 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.1750 1.5040 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0140 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.6600 -0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8780 -1.2690 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.2210 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -0.6290 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 1.0270 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 2.5550 -3.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6650 2.8640 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 3.0930 -4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 3.4800 -4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 3.9730 -5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 4.0810 -6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 3.6960 -6.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 3.2060 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 4.6090 -7.5850 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5720 4.9480 -7.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 4.7040 -8.7010 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9000 3.0670 -3.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -2.1600 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -2.8060 -0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -2.7780 0.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -4.2250 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.7460 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 1.9640 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 1.8900 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 1.7380 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.2480 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.3990 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -1.1730 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 0.2610 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 0.6410 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 0.7190 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 3.3950 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 4.2740 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 3.7800 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 2.9080 -5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 2.8310 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -4.6590 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -4.5050 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.4660 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -5.8320 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -4.3120 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 0.4990 -2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.3530 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 3 45 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 44 2 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END