IBS-ZINC04888546 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.6360 1.0380 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 1.4290 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 2.7820 -1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 0.5860 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 1.0540 -3.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.1280 -4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 0.0130 -5.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -1.2520 -3.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.8980 -2.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4630 -1.4040 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.2270 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.0130 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -2.2840 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -1.7720 -1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -0.9890 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -0.7250 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 0.0600 -4.0010 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -2.5990 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -2.8990 -5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -4.2060 -5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -5.2650 -4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -4.9810 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -3.6720 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -6.6660 -4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -6.8400 -6.0970 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8040 2.2230 -3.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.0460 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 1.4550 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 1.4260 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.4190 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -2.8950 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -1.9810 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -0.5750 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.1350 -5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -4.3950 -6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -5.7860 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -3.5360 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 2.9700 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -7.5680 -4.0700 O 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 2 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 26 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 39 2 0 0 0 0 M CHG 1 25 -1 M END