PUBCHEM-ZINC03766485 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 6.0810 -2.0900 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -2.1100 0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -2.1450 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -2.2800 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -2.3340 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -2.2400 -3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -2.1100 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 -2.0600 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -2.3180 -4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -1.5450 -5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -0.0540 -5.4810 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9590 0.2620 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 0.2010 -6.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -0.9640 -7.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 -1.1120 -8.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -2.0830 -6.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -3.3920 -6.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 1.5300 -7.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 2.1270 -6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7170 4.2390 -6.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 5.7170 -6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 5.9220 -6.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 6.8860 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 0.6650 -5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 1.6730 -4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 2.3730 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 2.0670 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.0690 -5.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 0.3730 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 2.7810 -4.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 2.4060 -5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -2.9610 -4.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 -2.9750 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -1.1690 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 -2.1130 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -2.3540 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -2.4490 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 -2.0740 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 -1.9650 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 1.4590 -8.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 2.1750 -7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 2.2150 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 1.5260 -6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 3.8710 -6.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 4.0420 -5.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 6.3530 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 5.9810 -7.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 1.9240 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 3.1530 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 0.8190 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.4030 -6.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -3.4000 -7.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 3.4950 -7.2010 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6990 3.4810 -8.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 4.1300 -7.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 32 2 0 0 0 0 10 11 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 M CHG 1 53 1 M END