IBS-ZINC02196036 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.0570 1.1870 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -0.2300 0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.7810 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -0.0400 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -0.6830 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -2.0810 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -2.8290 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -2.1890 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -2.8370 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -4.2620 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -4.6790 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -4.7860 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -5.2100 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -5.4130 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -5.0910 -1.4610 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 0.1220 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 1.3110 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 1.5950 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 2.4540 -2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5300 2.0110 -3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3510 3.1040 -3.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3540 3.0710 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 4.2610 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2800 3.8870 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3100 4.9030 -2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 6.2450 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0520 6.5850 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0330 5.5980 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 1.4400 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.6340 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 1.6000 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 1.0460 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -2.6110 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -3.9110 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -4.6200 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -4.6720 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -4.5650 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -5.3560 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 -5.7320 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -0.4290 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 1.0670 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 2.2340 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 0.7670 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 2.0830 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 0.6490 -3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9420 1.0130 -3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 4.6580 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 7.0300 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3430 7.6330 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0780 5.8670 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 0.4550 -1.2550 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6650 0.9200 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -0.4280 -1.7630 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 M CHG 1 51 1 M END