IBS-ZINC05025369 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0780 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2480 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.8910 -1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.2920 -1.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -6.9730 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -6.4170 -3.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -7.3600 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -8.5940 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -8.3270 -2.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -9.3120 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -9.6810 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -10.6420 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -11.0780 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -12.0110 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -12.4540 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -11.9680 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -11.0380 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -10.5880 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -9.7700 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -10.8620 -4.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -9.6750 -5.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -10.4840 -6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -8.4780 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -8.4310 -7.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -7.3280 -5.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -6.0430 -6.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6190 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5960 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.7930 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.7810 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -10.2050 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -8.8880 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -8.7870 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -10.1050 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -12.3910 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -13.1800 2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8620 -12.3150 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -10.6610 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -9.8590 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -5.7100 -6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.1580 -7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -5.3050 -5.9650 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 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 M END