IBS-ZINC00703019 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.1930 1.0660 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.0740 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.5910 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.0890 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 1.2190 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 1.7260 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 1.5790 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 0.6550 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.2430 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 0.6320 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 1.8930 -0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -0.4890 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -1.8590 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 -2.8110 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -4.0260 -0.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 -2.0480 -0.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -0.6130 -0.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3160 -0.1900 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 0.0200 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9470 0.8790 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 1.4330 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4330 1.1010 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 0.2710 -3.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 -0.2420 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5810 -2.6370 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3260 -3.1670 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5300 -4.0590 -1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7610 -4.8620 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3910 -6.1650 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5330 -6.0960 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2350 -5.3570 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -2.2190 -1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 1.4460 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.5700 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -1.4730 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 2.6090 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 2.4230 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1760 1.1240 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5480 2.1040 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0130 1.5060 -4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8840 -0.8990 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -1.8950 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3760 -3.4570 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 -3.8180 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 -2.3270 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8050 -3.0410 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 -4.5570 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4300 -4.9880 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3240 -4.3460 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3060 -7.1220 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0670 -5.6130 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6830 -5.8650 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6110 -5.2570 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 1.8960 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5640 -3.9560 -0.7730 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0550 -3.4470 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 55 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END