SPECS-ZINC04659039 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 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 1.0610 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.8800 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -2.5720 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1550 -2.6980 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -3.5580 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -3.3020 -1.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -4.0540 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -4.9450 -0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -3.8190 -2.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -4.6680 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -4.2590 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 -4.8420 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -4.4680 -6.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3700 -3.5100 -6.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7980 -2.9280 -5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -3.3060 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.8360 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -3.1780 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -3.4190 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -3.3190 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -2.9760 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -2.7300 2.4920 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 -1.6040 -4.5770 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -3.4320 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -2.5910 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -5.7070 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -4.5620 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -5.5900 -5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 -4.9220 -7.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -3.2170 -7.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5760 -2.1800 -5.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 -2.8540 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -3.2560 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -3.6870 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -3.5090 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.8980 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -2.4590 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END