IBS-ZINC05452377 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8090 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.6660 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -4.0300 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5550 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -3.6920 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.3260 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.4840 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -2.0820 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -0.9850 -5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -6.0160 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -6.4710 -2.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -6.8460 -0.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -8.2970 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -9.0040 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -10.4960 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -11.2670 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -12.5360 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -12.5790 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -11.3280 -0.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -11.0680 -0.9660 H 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -2.2620 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -4.6950 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -4.0940 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -2.6920 -4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -2.7090 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.4420 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -0.3750 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -0.3580 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -6.4840 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -8.5940 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -8.5770 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -8.7070 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -8.7240 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -10.9250 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -13.4690 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 M END