MMs02279397 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 62 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 1.2953 -0.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2879 -2.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -3.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5759 -4.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2732 -5.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0148 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3101 -2.2436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6128 -2.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9081 -2.2308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9008 -0.7308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4988 -0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5062 -2.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2109 -2.9744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8089 -2.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8163 -4.4616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1042 -2.2052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1464 -2.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0968 -0.7052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 0.0384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.0512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8712 -5.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1739 -4.5255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8638 -6.7691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1592 -7.5255 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1199 -8.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4619 -6.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7572 -7.5383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0599 -6.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0673 -5.2947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1518 -9.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4471 -9.7819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 -1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2953 0.4436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1929 -1.0550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6402 0.5821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0032 1.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6254 -2.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2673 -6.4563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0643 -5.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3042 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -3.9102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3887 -3.9026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8586 -0.1359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3863 1.2512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4344 -0.5437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8217 -7.3640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6951 -5.8589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2377 -5.8665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9813 -8.4537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 -8.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3552 -7.5511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8491 -9.7691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8431 -10.9691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3974 -6.9562 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 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 34 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 57 1 0 0 0 0 34 35 2 0 0 0 0 34 58 1 0 0 0 0 57 60 1 0 0 0 0 58 59 1 0 0 0 0 M END