MMs01264653 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 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 -1.4969 0.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0507 -1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8961 -2.2556 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3714 -1.4533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -1.6695 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8754 -0.2162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1327 -3.1228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9573 -2.0408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0056 -0.9679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4589 -1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 -2.7835 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8157 -3.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3624 -3.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3173 -3.1549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7223 -4.5991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3655 -2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8188 -2.4533 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.8671 -1.3804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4620 0.0639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.3204 -1.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3686 -0.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8219 -1.0501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2270 -2.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1787 -3.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7254 -3.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5838 -5.0116 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -17.8702 0.0228 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -17.4651 1.4671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.3235 -0.3486 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7660 0.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1387 1.1099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 -1.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0147 -0.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5001 0.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5496 -0.1427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6530 -1.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8066 -4.5332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3212 -4.9498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1683 -3.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2717 -4.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3746 -1.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8600 -0.9885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1429 -3.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0446 0.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3896 -2.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8868 -4.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 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 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END