NCID-ZINC05120777 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.5280 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -0.1490 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 0.9990 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 1.3500 1.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 0.5980 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -0.5670 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.9070 0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -1.3660 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 -0.9490 -0.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 0.1560 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 0.9100 0.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2110 0.5330 0.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -2.5120 -1.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.5200 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.2930 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.8020 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -1.5480 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -1.7760 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -1.2600 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -1.4770 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.2420 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -2.0930 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -2.7420 -1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -1.8730 0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4620 -2.4150 0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4390 -3.3820 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0270 -2.5870 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -3.6450 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7700 -3.8150 4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7200 -3.1580 4.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3360 -1.4650 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 -0.4410 -0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8420 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8260 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8160 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.1040 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.6130 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 1.6070 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 -0.0040 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 1.3350 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -2.8020 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -3.0280 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 0.2830 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -0.6240 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -2.3520 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -3.2320 -2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.7380 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.3400 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -1.3550 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9690 -1.6380 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0680 -2.9060 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 -4.5930 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 -3.3260 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -4.6960 4.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6310 -1.7570 -0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1520 -1.1180 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -4.7700 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 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 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 M END