NCID-ZINC05030556 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -5.2460 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -5.6490 -1.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -5.8850 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -5.6970 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -5.2630 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -5.0890 2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -6.0030 2.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -6.3610 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -6.3030 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -6.6290 -0.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9480 -7.1010 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1690 -5.3560 -1.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7800 -4.9630 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6260 -5.8380 -1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.9570 -5.6850 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5650 -7.3460 -1.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4470 -7.9300 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -7.4950 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8270 -7.7800 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8030 -9.2190 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8470 -9.7630 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7490 -9.0610 0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 -11.2500 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5070 -5.1480 -0.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7770 -4.9600 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1400 -5.3590 -1.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7490 -4.2520 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0870 -4.3490 -0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -3.4700 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -3.5400 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -2.3960 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.0660 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -6.6590 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8630 -7.2820 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7060 -7.5060 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4160 -11.4790 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9300 -11.5830 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3630 -11.7640 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2440 -3.9680 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1250 -3.3580 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5810 -4.9160 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 -2.8590 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 -1.7840 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -1.7710 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 50 1 0 0 0 0 13 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 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 51 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 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 35 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 57 1 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 60 1 0 0 0 0 42 61 1 0 0 0 0 42 62 1 0 0 0 0 M END