PUBCHEM-ZINC04523441 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 70 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -1.2330 0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2060 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -0.7130 -0.9780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9920 -0.7600 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 0.2230 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 1.5890 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 2.5120 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 2.1160 -2.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 3.7760 -1.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 4.6730 -2.2700 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4180 4.4590 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0000 4.4580 -1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 3.0430 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8930 2.8280 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3260 1.4130 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 6.1030 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 6.3490 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 7.1090 -2.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 8.4990 -2.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1180 8.5990 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 8.8950 -3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 9.4000 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 8.9270 -2.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4900 10.7310 -2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6360 11.6060 -2.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.2130 11.2140 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5220 11.6650 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1450 12.9920 -3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 13.2240 -3.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -2.0920 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -2.6010 -1.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -2.7590 -1.6820 N 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 -1.9530 0.3600 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 0.3400 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 -0.1990 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 1.4720 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 2.0120 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 4.0930 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 4.5840 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 5.1850 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 2.9160 -3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 2.3160 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9970 2.9540 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5220 3.5550 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2220 1.2860 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6970 0.6860 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0380 0.2780 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 6.9120 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 8.7940 -4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 9.9290 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 8.2430 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 11.1090 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3750 12.3160 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8770 10.6630 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9450 12.0570 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -2.3520 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -3.6470 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.4980 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7280 1.2060 -1.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.8630 1.3810 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0250 13.9680 -3.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4910 1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -0.1540 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6630 14.8400 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 69 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 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 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 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 66 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 68 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 54 66 1 0 0 0 0 65 69 1 0 0 0 0 66 67 1 0 0 0 0 68 71 1 0 0 0 0 69 70 1 0 0 0 0 M END