IBS-ZINC02100980 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 60 0 0 1 0 0 0 0 0999 V2000 -0.1300 2.0600 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.6520 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.0890 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 0.4460 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -0.3910 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.7850 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -2.3160 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -1.4840 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.1190 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -2.6160 -0.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -2.0130 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -0.7930 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -0.5360 -2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -1.4580 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -2.6750 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -2.9470 -2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -4.0380 -2.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -3.8310 -1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -2.7160 -0.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2380 -3.7510 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -2.4170 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8180 -2.4250 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2150 -2.1110 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4580 -1.9590 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4870 -1.6400 -5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 -1.4740 -5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -1.6210 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -1.9390 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -2.1410 -3.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -2.0860 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6390 -2.7150 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7920 -3.4210 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 2.4790 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 2.3060 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 2.5130 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 1.5180 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 0.0680 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -3.3980 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.4310 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.9680 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -0.0740 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 0.4000 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -1.2290 -4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -3.3920 -4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3880 -2.0860 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4430 -1.5210 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 -1.2270 -6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -1.4920 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0250 -1.7700 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5000 -3.3430 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2970 -3.4110 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -4.4560 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -2.7130 0.6050 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9460 -3.1290 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 -1.7360 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 18 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 M CHG 1 53 1 M END