IFLAB-ZINC04134658 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.5550 0.8480 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -0.4090 -1.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -0.9520 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -0.3730 -1.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -2.1970 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -2.7740 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -4.0520 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -4.9140 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -6.0820 1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -6.4490 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -5.6320 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -4.4230 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.1980 -0.5670 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -2.1920 0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -2.9520 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -4.1580 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0880 -2.3180 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -0.9330 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4530 -0.3480 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5890 -1.1310 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4810 -2.5040 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -3.1010 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7240 -3.3490 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8540 -2.5250 0.0110 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.7060 -4.0430 -1.2530 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.7660 -4.2620 1.0210 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 1.1710 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 0.7410 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 1.5890 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -4.6420 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -6.7310 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -7.3790 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -5.9220 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 -1.2400 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -0.3210 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5450 0.7230 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5650 -0.6680 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -4.1730 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 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 M END