IBS-ZINC04956787 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 0.6330 1.4300 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 0.1440 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -0.8380 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -1.7120 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -2.9180 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.5840 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -4.7940 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -5.3580 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -4.7120 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -3.4930 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.5620 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -2.6980 4.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -3.8860 5.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -3.9810 6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -3.0380 7.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -5.2580 7.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7100 -5.5250 7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -6.3870 6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -7.5790 7.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -7.4590 8.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -8.5970 9.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -8.4910 10.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -7.2530 11.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -6.1150 10.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -6.2140 9.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -5.0840 8.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -1.4520 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -0.4730 2.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 1.7870 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 2.1330 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -0.2130 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -1.4410 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -0.2960 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -3.1540 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -5.3040 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -6.3050 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -5.1510 3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -4.6400 4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.5460 5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -6.1220 6.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -9.5660 9.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -9.3780 11.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -7.1740 12.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -5.1490 11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 M END