MMs00466862 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7413 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0174 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2412 -1.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0201 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5999 1.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2587 1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7587 1.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2412 -1.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4825 -2.6282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7411 -1.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7411 -1.3644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9824 -2.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4824 -2.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2410 -1.3744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9997 -0.0804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9823 -2.6784 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5823 -1.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4823 -2.6885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2236 -3.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6043 -5.3587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7123 -6.3699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5788 -7.5624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0163 -5.6286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7143 -4.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8357 -3.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2591 -3.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5612 -5.1055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4397 -6.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 -0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4587 -1.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0526 -1.9911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6244 -3.6332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0178 -3.2050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0249 -2.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3661 -1.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1069 1.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1411 -2.3835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 0.3677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7161 1.1301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7993 1.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1302 0.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1072 -3.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7661 -3.8387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3521 -3.0511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6829 -3.8314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2818 -1.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6126 -2.2856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4289 -5.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5941 -1.9877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1563 -2.8392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6999 -5.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6814 -7.2771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0237 -3.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0173 2.5779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2236 -3.9724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8166 -5.0157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4243 3.6211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 60 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 61 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 59 61 1 0 0 0 0 60 63 1 0 0 0 0 61 62 1 0 0 0 0 M END