IBS-ZINC02350839 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 1.6830 2.1290 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 0.7540 0.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.1060 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -1.4060 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -1.8070 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.9410 -0.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.9250 -1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -1.1990 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 0.3300 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 1.1000 -1.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.0310 2.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.1120 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.0210 2.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -1.3300 4.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -2.0480 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -1.2830 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.0320 5.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -0.0680 5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 0.3850 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 0.0720 5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 0.4870 5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 1.2160 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 1.5300 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 1.1190 3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -3.4140 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -4.3430 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -6.0550 2.7750 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -6.8820 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -8.1570 3.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -8.6410 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -9.9800 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -10.2840 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -9.2810 3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 -7.9670 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -7.6400 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -6.0860 3.1620 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 2.1630 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 2.7800 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.4660 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.1280 6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -3.0470 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -1.8700 5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.1040 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 0.5080 5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -0.2170 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.6920 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -0.4980 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 0.2410 5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 1.5400 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 2.1000 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 1.3680 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -3.4970 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -3.6980 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -4.2420 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -4.0740 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -10.7710 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -11.3130 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 -9.5310 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -7.1870 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 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 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 36 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 M END