PUBCHEM-ZINC05865683 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 0.7430 0.1220 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.3760 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -1.7670 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -3.2660 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -3.6570 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -5.1550 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -5.5300 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -5.4800 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -5.1280 -2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -5.8590 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -6.2520 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9800 -6.5470 -0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 -6.8510 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 -6.3370 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 -5.9270 -2.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9010 -5.6080 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -5.3520 -4.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6780 -4.4080 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2320 -6.4930 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3510 -6.5120 -2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5820 -6.6970 -1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1440 -5.6650 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3610 -5.8500 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0190 -7.0620 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4610 -8.0910 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2480 -7.9100 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1820 -9.4100 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3460 -7.2610 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1700 -5.2810 -5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 -6.2730 1.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -5.9230 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -5.9580 2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 -6.6860 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 0.4010 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 0.6830 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 0.3510 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.6040 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.9370 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -1.5390 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.2060 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -3.4940 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.8270 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -3.4290 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -3.0960 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -5.3840 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -5.7160 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 -4.7160 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -6.4450 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2130 -6.3260 -4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8260 -7.4430 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6310 -4.7180 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7990 -5.0480 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8150 -8.7130 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8400 -9.3900 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4530 -10.2130 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7720 -9.5810 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1510 -6.9700 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4610 -8.3100 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3860 -6.6460 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 -6.2250 -5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1540 -5.0990 -5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4960 -4.4700 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 -7.7640 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -6.1740 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5750 -6.4280 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 2 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 M CHG 1 15 1 M END