MMs01726363 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 -0.1653 -1.4909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5391 -2.0931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7044 -3.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -4.4726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5045 -5.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9194 -6.4442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -5.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 -4.0172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0782 -4.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2435 -5.6771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2867 -3.2976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6605 -3.8999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6605 -2.6999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0577 -3.3543 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7472 -2.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6033 -4.7516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 -5.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6038 -6.6710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0861 -4.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0234 -3.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4779 -2.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9950 -2.1832 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.5063 -4.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4436 -2.8618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9264 -3.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8637 -1.9168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.4720 -4.4852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6317 -6.3751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1145 -6.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1927 -0.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1323 1.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1927 0.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4794 -6.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2837 -7.5876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -5.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1544 -2.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6545 -2.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4501 -1.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1221 -5.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5591 -4.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6583 -4.6662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7221 -5.4221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6944 -7.5462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1308 -8.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 29 30 2 0 0 0 0 29 44 1 0 0 0 0 44 45 1 0 0 0 0 M END