IBS-ZINC00174826 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 1.2170 1.4250 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 0.1250 -0.6850 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6210 -0.0780 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -1.2920 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -2.3020 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.0520 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.8110 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -3.1170 -2.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4260 -2.6690 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -3.7800 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -4.9510 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -5.9900 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -5.3530 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -4.1400 -2.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -3.9700 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -2.9720 -0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -4.9970 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -5.2200 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 -6.1810 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -6.9220 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -6.7070 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -5.7530 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 1.4070 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.6340 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 2.2020 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 0.7140 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -1.4520 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -3.2610 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.6060 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -4.1460 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -3.0510 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -5.4090 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -4.5880 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -6.3360 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -6.8350 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -6.0570 -2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -5.0890 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -4.6410 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -6.3540 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -7.6730 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -7.2890 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -5.5890 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 2 1 M END