IBS-ZINC02167017 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 0.0440 1.4500 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0710 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.5720 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -0.7980 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -2.2470 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -2.4930 -3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -3.9310 -3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -0.8080 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -1.3890 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -1.6260 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -1.2840 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -0.7090 3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -0.4790 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -0.3310 4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.1810 4.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -0.5800 6.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.3270 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -1.1590 6.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -1.3180 7.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -1.5320 4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -2.0490 5.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.8080 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8840 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.8360 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -0.3920 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.5080 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -0.5240 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -0.1280 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.4720 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -2.9410 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -2.2770 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -1.8040 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -4.1700 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -4.6490 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -1.6840 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -2.0780 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.0160 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -4.1230 -4.8910 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8470 -5.0880 -5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -3.5000 -5.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -3.9460 -4.8470 H 0 0 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 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 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 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 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 M CHG 1 38 1 M END