MMs00029560 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 59 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 1.5000 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7602 1.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7395 -1.3288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2396 -1.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 1.2453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7395 -1.3527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2394 -1.3646 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6394 -2.4039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2393 -1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4790 -2.6815 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6790 -2.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -2.6696 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5790 -3.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2187 -3.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2186 -3.9865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2600 1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5203 2.5145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7599 1.1976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5202 2.4906 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1202 1.4514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7806 3.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5409 5.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8013 6.3936 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.1062 7.1332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4963 5.6539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0616 7.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0202 2.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7805 3.7717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7598 1.1737 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6685 2.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3685 2.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3313 -2.3728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6313 -2.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1312 -2.3871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4080 0.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1647 -0.6245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1524 -2.1671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8104 -5.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4186 -3.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3516 0.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8552 3.0316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8675 4.5742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4540 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4663 5.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1056 8.2902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4699 8.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0177 7.1068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1516 0.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9598 1.1642 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 M END