PUBCHEM-ZINC04654927 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 72 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.6230 -0.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6650 -2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -4.1300 -2.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8520 -4.4810 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.6360 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -4.2180 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -3.0090 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -2.6230 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -3.4490 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -4.6620 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -5.0460 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 -3.0710 -1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.6510 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -3.9370 -1.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -5.9110 -2.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -6.4180 -2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -7.8640 -3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -8.3940 -3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -10.3240 -3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -11.7680 -4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -12.3330 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -13.7770 -4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 -15.7080 -5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -16.2370 -5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 -17.6830 -5.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -2.1700 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -4.2130 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -5.7240 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -2.3660 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -1.6780 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -5.3060 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -5.9920 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 -3.3590 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -6.4820 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -6.3820 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -5.8020 -3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -7.9000 -4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -8.4800 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -8.3570 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -7.7770 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -9.7210 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -10.3010 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -11.7910 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -12.3710 -3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -12.3100 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -11.7300 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -13.8000 -5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -14.3800 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -16.3240 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -15.7440 -6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1070 -16.2010 -4.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3340 -15.6210 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3350 -17.7190 -6.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1080 -18.2990 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1420 -19.1450 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -9.7820 -3.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -9.8510 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -14.3200 -4.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -14.2500 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1060 -18.1910 -5.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5150 -18.1080 -4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 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 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 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 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 67 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 69 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 27 69 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 29 71 1 0 0 0 0 66 71 1 0 0 0 0 67 68 1 0 0 0 0 69 70 1 0 0 0 0 71 72 1 0 0 0 0 M END