MMs01388474 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 67 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 1.2526 0.8252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3213 2.3236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7676 2.7214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5928 1.4688 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6565 0.2969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0912 1.4001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 0.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2794 -0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9692 -1.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1605 -2.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6621 -2.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9723 -1.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2959 4.1253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1494 3.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3743 4.7430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2474 2.7132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4193 3.6495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8162 3.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0411 1.6197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8692 0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4724 1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4379 1.0729 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9846 2.4698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8911 -0.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8347 0.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0596 -0.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4564 -1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6283 -0.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4034 0.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0066 1.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5753 1.8520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9721 1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1970 -0.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0251 -1.1140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6602 1.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0021 -0.6602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6602 -1.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9371 2.5902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2364 1.7585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9263 1.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1679 -1.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7123 -3.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0151 -3.5379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7736 -1.1403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 3.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7186 5.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1728 4.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5189 4.4427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0441 4.6740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0529 4.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0158 3.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7696 -0.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2444 -0.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2727 1.2590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2356 0.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1221 -1.7059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6363 -2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8266 2.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2088 2.4817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1717 1.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3342 0.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7718 -1.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 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 22 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 M END