IBS-ZINC05093653 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6850 -1.7310 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.7260 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -4.3460 -4.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -4.3680 -2.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -5.8150 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -6.2830 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -6.6840 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -7.1060 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -7.1130 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -6.7250 -0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -6.3230 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -1.7830 -4.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -0.5050 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 0.2690 -3.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.0880 -5.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 1.3010 -6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.5830 -7.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 2.0210 -6.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 2.2810 -8.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 2.1020 -9.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 1.6650 -9.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.4100 -8.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -3.8720 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -6.3210 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -6.0480 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -6.6670 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -7.4250 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -7.4410 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -6.0160 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.4010 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.9490 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.4900 -6.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 2.1610 -5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 2.6220 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 2.3040 -10.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 1.5260 -10.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.0720 -8.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 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 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END