IBS-ZINC02212640 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.6980 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -0.4930 2.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.1670 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.5730 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.5220 5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -3.6450 5.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -4.8190 5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -6.0240 5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -7.2140 5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -7.2600 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -6.1160 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -4.8660 3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -3.7340 3.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -1.1870 5.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -0.3920 4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 0.9780 4.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -0.7170 6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -0.0070 6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 0.4570 7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 0.2150 8.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -0.4990 9.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -0.9560 7.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 0.7100 10.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 1.3300 10.0850 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -6.0050 6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -8.1350 5.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -8.2160 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -6.1670 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 1.4760 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 1.4500 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 0.1800 5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 1.0080 7.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -0.6880 9.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.5040 7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 0.4760 11.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 0.8200 12.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 46 47 1 0 0 0 0 M END