IBS-ZINC06623791 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -2.6980 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -4.1080 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -4.7060 0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -4.8090 1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -4.1940 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -2.7880 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -2.1470 2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.8890 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -4.2810 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -4.9320 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -5.0050 3.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -4.2740 3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6330 -5.2380 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -6.4330 4.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -4.7720 4.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -5.7080 5.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 -4.9260 5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0100 -5.8900 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0850 -6.3300 5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8020 -7.1940 6.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.6200 -7.6420 6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1910 -7.3360 7.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0380 -6.5290 7.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2080 -6.4780 8.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5190 -7.2160 10.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6530 -8.0160 10.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4900 -8.0750 8.9310 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -2.1610 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -1.0680 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -2.3940 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.0120 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -3.6460 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -3.6470 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 -3.8160 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -6.3370 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -6.3350 6.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6240 -4.2980 6.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4010 -4.2990 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3450 -6.0430 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -5.8590 8.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8770 -7.1760 10.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8860 -8.5930 10.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3690 -8.7020 8.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END