IBS-ZINC05556897 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.0520 1.6070 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.0880 -0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9530 -0.2970 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.6280 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -1.3330 -1.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.5220 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.0540 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -0.1300 -4.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 0.1510 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -0.6490 -4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.9120 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.4620 -4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.7250 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.4490 -6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.9050 -6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.3920 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -1.0800 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -0.4160 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -0.3120 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.3920 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.9960 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 1.9320 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 2.0900 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 0.3210 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -1.6850 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -2.1490 -5.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -1.6600 -7.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.6940 -6.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.9610 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 0.6360 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -1.0670 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.1340 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 0.5880 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -0.9860 4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 0.2350 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 -1.3170 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 1.4230 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 0.3850 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.3400 1.2670 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1240 -1.3100 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END