IBS-ZINC02227623 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 0.0310 2.4730 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 2.5610 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 1.6460 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 0.6390 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 0.5530 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 1.4690 1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -0.2960 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -0.1700 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -1.2950 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -2.1190 -1.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 -1.3590 -1.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 -2.4030 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -3.5530 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2420 -4.6120 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 -5.7480 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4190 -6.7890 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6300 -7.8790 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -8.5610 0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 0.9230 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 1.2920 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 0.6290 0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 2.6020 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 2.7400 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 3.9550 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 5.0360 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 4.9060 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 3.6930 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 3.1840 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 3.3410 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 1.7250 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -0.2260 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 1.4000 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -1.1310 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -0.6370 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -2.7610 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 -1.9470 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6620 -3.1630 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -4.0070 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 -5.0150 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 -4.1490 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -5.3430 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -6.2170 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -7.2530 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 -6.3170 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 1.5530 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8890 1.9040 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 4.0590 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 5.9820 2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 5.7550 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 3.6330 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8120 -7.9770 0.8040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 19 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 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 51 -1 M END