MMs00029939 MOE2007 2D CORINA 3.40 0006 02.08.2006 72 75 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 0.4703 -1.4244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4056 -2.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4818 -3.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9062 -3.3811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8991 -1.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1084 -0.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9445 0.4973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4816 -1.5973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6909 -0.7098 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6517 -0.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6838 0.7901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1082 1.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9956 0.0511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1197 -1.1666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2712 -2.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5916 -3.7104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4956 0.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2394 1.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2517 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7517 -1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5079 -2.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7641 -3.8281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0079 -2.5184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8838 -1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3125 -1.7575 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.0020 -0.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3197 -3.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8953 -3.7278 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.7438 -4.5763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4385 -5.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9728 -5.4754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5219 -0.8701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.8951 -1.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0589 -2.9647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1044 -0.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0973 0.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5216 1.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4091 0.1747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5332 -1.0430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0035 -2.4673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1395 0.3762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3762 1.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1395 -0.3762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6056 -2.6478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1164 -4.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8803 -4.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6127 -2.7901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 0.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4287 1.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6149 2.3544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1445 1.8654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1261 -1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4657 -2.4180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5377 -0.0493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8774 -0.8143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8417 -0.7057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3666 -0.2022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5125 -3.1264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5747 -4.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3908 0.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1231 1.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8870 2.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6090 0.1804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8640 -2.8436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3797 -3.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1429 -2.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0587 -2.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4475 -6.2665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0821 -7.4095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4349 -4.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 48 1 0 0 0 0 6 7 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 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 69 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 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 34 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 70 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 2 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 63 1 0 0 0 0 39 40 2 0 0 0 0 39 64 1 0 0 0 0 40 41 1 0 0 0 0 40 65 1 0 0 0 0 41 42 1 0 0 0 0 42 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 69 72 1 0 0 0 0 70 71 1 0 0 0 0 M END