IBS-ZINC02127615 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0090 -0.4110 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.5360 1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7770 -0.1100 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.0590 0.7250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0470 -2.6520 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -2.3580 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -3.0960 1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -1.6190 2.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.6610 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.0610 3.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -1.8380 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 -0.9960 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 0.2870 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 1.0600 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 0.5490 4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -0.7340 4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 -1.5080 3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -1.8780 -0.7440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7610 -1.9980 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.3020 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -1.6600 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -2.7150 -1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -3.4100 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -3.0550 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.5880 -2.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -2.9500 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -3.1920 -1.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.5570 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.8900 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.6860 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 2.0620 5.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 1.1530 4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -1.1330 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -2.5120 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -0.4760 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -1.1160 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 -2.9970 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -4.2310 -3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -4.3320 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.5360 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.5970 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 45 46 1 0 0 0 0 M END