IBS-ZINC05450812 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 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 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.0730 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0230 -1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4160 -2.3260 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.6220 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -3.3670 -0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.4960 -2.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -3.6750 -3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -4.3450 -2.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -4.1610 -4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -5.5150 -4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -6.0080 -6.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -7.3410 -6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -8.5500 -6.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -9.5290 -6.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -10.4820 -6.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -8.9580 -7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -7.5630 -7.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -6.7180 -7.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -7.2520 -8.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -8.6280 -8.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -9.4800 -8.0930 C 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 2.6610 -0.5060 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.4250 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.0140 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -1.9600 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -3.4410 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -4.2690 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -6.2350 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -5.4070 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -5.2880 -6.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -6.1160 -5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 -8.7250 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -5.6470 -7.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -6.5980 -9.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -9.0340 -9.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -10.5490 -8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -2.3280 1.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.7360 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 46 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 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 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 M END