IBS-ZINC02115426 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 -1.4330 -0.5340 0.0130 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 2.1870 -0.0730 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.5460 -2.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -0.2860 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.3380 -1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -0.7720 -3.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5430 -1.7800 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 0.1600 -5.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 0.6620 -5.6610 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 -0.7110 -4.8470 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0640 -1.6320 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -0.8150 -3.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -0.8910 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 -1.2980 -1.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -0.4090 -3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 -0.2820 -4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5490 0.1660 -5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7420 0.4780 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8590 0.3400 -3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 -0.0950 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8550 -0.2360 -1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3030 -1.5030 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0350 0.6410 -2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1050 1.0930 -3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 1.3800 -4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -0.5950 -6.0670 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 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 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 2.2500 1.0140 -1.1560 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 2.3840 -1.0450 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 0.2760 -6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5830 0.8300 -5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -2.2820 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2980 -1.7120 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3410 -1.4810 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9820 1.2980 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3460 0.3230 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8030 2.0040 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 1.9330 -3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 2.0250 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 1.0520 -4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -0.9770 -5.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 0.0810 -6.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -1.4270 -6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END