MMs02494724 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 0.7533 1.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0065 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0075 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 -1.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9935 -2.6056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7467 -1.3009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0065 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6065 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7402 -3.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5065 -2.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2533 -1.2934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2532 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5065 2.5868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7532 1.2821 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1532 2.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5065 2.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0065 2.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7532 1.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2532 1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0065 2.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2597 3.8689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7597 3.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0377 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4467 1.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0473 3.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5909 3.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 2.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0478 2.4757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3819 1.7010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.7805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3005 -4.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3376 -4.9397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -3.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0974 -1.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 2.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7178 3.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1506 0.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8506 0.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2065 2.5649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8623 4.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1624 4.9134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8974 -1.0565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2598 -3.8915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 -0.0218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4598 -3.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 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 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 48 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END