PUBCHEM-ZINC04102217 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.4300 -0.3660 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -0.0330 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.5890 1.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0110 -0.1590 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.7480 3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -2.6340 2.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5850 -3.7300 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -2.1450 1.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4100 -2.4290 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -2.8770 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -2.1170 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -2.7300 3.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -0.7910 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -0.0270 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 1.2810 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 1.7700 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 0.9920 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -0.2900 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 3.0290 0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -2.8610 5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -2.8780 6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -4.0540 7.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -3.8080 6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -1.4420 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 0.1020 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 0.0040 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 1.0560 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.4090 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 0.9350 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.4470 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -0.2970 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.5850 4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -2.6860 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -3.9610 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -2.5890 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 1.9320 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 1.3870 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -0.8860 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 3.4550 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -2.3000 5.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -3.8840 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.8980 6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -4.9100 6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -3.8560 8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -3.4470 6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -4.5120 5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -2.2370 3.8010 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1550 -2.6660 3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END