CHEMSTAR-ZINC04018262 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 0 0 1 0 0 0 0 0999 V2000 -0.7390 2.7610 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.2430 1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5950 0.8870 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.5910 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -0.0920 3.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.7660 2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 0.1330 3.3670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5290 0.1150 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.2990 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.1150 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -2.1840 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -2.9310 1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -3.6130 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -3.5430 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -2.7990 4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.3490 2.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 0.9160 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 1.9060 2.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5160 4.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 1.2440 4.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 0.8300 5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -0.2360 6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0530 -0.6430 7.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 0.0080 7.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5540 1.0680 6.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 1.4770 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 2.6090 4.7560 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5490 2.5850 3.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 3.5640 5.1690 O 0 5 0 0 0 0 0 0 0 0 0 0 9.2720 -0.4320 8.4340 N 0 3 0 0 0 0 0 0 0 0 0 0 9.0230 -1.3650 9.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3440 0.1400 8.5130 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3200 0.9010 1.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 0.9180 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 1.2170 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 0.6050 0.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 0.6440 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 0.2660 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 1.2430 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 0.8970 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -0.4270 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 -1.4040 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -1.0570 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 3.0160 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 3.2330 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 3.1180 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 1.3120 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -1.2870 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -1.7410 3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -1.6520 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -2.9840 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -4.0730 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -2.7480 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -5.2690 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -0.2760 4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.0360 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -0.7440 6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -1.4700 8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5050 1.5750 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 0.6630 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 1.6500 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -0.0600 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3240 2.2770 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6120 1.6600 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3200 -0.6980 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -2.4380 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 -1.8200 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 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 47 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 48 1 0 0 0 0 9 49 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 50 1 0 0 0 0 12 13 1 0 0 0 0 12 51 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 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 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 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 63 1 0 0 0 0 40 41 1 0 0 0 0 40 64 1 0 0 0 0 41 42 2 0 0 0 0 41 65 1 0 0 0 0 42 43 1 0 0 0 0 42 66 1 0 0 0 0 43 67 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 30 1 M CHG 1 32 -1 M END