IBS-ZINC04085660 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.1990 1.7510 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 0.2340 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -0.3450 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -0.4440 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -0.0770 -1.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5950 1.0050 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -0.6870 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -1.7830 -2.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -0.6510 -0.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -0.0560 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 1.0770 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -0.8520 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -2.2500 1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 -2.9820 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 -2.2670 3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 -0.8720 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -0.1530 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -0.4980 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -1.6510 5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -2.7140 4.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 -3.6870 4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.2150 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 2.0180 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 2.2010 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.0130 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -0.1580 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -1.4280 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 0.1010 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -1.5340 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.2080 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.5470 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -2.8030 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 -4.0670 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 0.9340 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 0.5090 4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -1.8080 5.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -0.0250 -3.7470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 37 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 34 1 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 1 0 0 0 0 M CHG 1 37 -1 M END