IBS-ZINC00508311 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.0050 1.4690 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0380 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7500 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.1320 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.8020 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.0890 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.7070 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.5630 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -4.9350 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -4.9800 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0730 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -4.7920 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -4.1640 -2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -5.2070 -1.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 -4.8370 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -4.7210 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -4.3540 -4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 -4.1010 -4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -4.2120 -2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 -4.5870 -1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 -4.7130 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -4.9400 0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.8440 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8420 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.8100 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.2270 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.6890 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6120 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.1500 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -5.5740 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -5.7630 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -4.9160 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -4.2640 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8250 -3.8140 -4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7040 -4.0130 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 -4.5760 -0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -4.6670 0.7040 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 36 37 1 0 0 0 0 M END