PUBCHEM-ZINC06171504 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -2.1080 0.0220 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 0.8060 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.9010 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.1000 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 0.7470 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 0.1020 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -1.1980 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -1.8450 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.1930 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -1.8540 -4.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -1.6390 -5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -0.8130 -6.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -2.4230 -6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -1.9270 -8.1370 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8870 -0.8660 -8.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 0.0260 -8.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 1.0180 -9.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 1.1520 -10.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 0.2850 -10.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.7300 -10.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -1.7380 -10.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.9160 -10.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.4400 -8.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -3.6340 -8.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0730 -4.2440 -7.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -3.1580 -7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -4.3670 -7.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -3.8030 -6.7700 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -5.3520 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -4.4300 -9.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -3.9920 -10.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -5.7700 -9.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -6.3100 -8.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -6.5820 -10.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -7.9560 -10.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -8.7090 -11.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -8.1040 -13.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -6.7430 -13.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -5.9780 -12.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -0.0460 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -0.9810 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 0.5330 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.8090 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.1020 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.4600 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.4120 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 1.7580 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.6080 -4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.8560 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -1.6940 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -2.4650 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -2.3050 -6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -3.4780 -6.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.0700 -7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 1.7050 -9.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 1.9420 -11.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.3940 -11.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -2.4940 -7.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -2.6230 -8.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -5.0320 -8.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -4.9020 -6.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -5.1320 -5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -5.9920 -7.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -5.8620 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -8.4300 -9.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -9.7720 -11.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -8.6980 -14.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -6.2770 -14.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -4.9150 -12.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 51 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 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 18 19 2 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 38 2 0 0 0 0 37 67 1 0 0 0 0 38 39 1 0 0 0 0 38 68 1 0 0 0 0 39 69 1 0 0 0 0 M CHG 1 14 1 M END