MMs02504162 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2399 -1.3164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -1.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 1.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.2816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7599 1.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2598 1.2350 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6598 2.2743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1509 2.4417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9994 3.2902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5738 1.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5622 0.4672 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6014 1.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1321 0.0147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7689 -0.4239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1990 0.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0712 -1.1918 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1802 -2.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7572 -1.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6348 -2.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9352 -4.3885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3582 -4.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4807 -3.8680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6587 -6.3326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2118 -2.4443 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.6984 3.8718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7107 4.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2583 6.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2706 7.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7354 7.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1878 5.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1755 4.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7477 8.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0093 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6318 -2.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3317 -2.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 2.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6681 2.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6355 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9774 2.4268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8324 3.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7662 1.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5786 1.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7607 -7.1286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7970 -6.7123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0865 6.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9086 8.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3596 5.5038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5375 3.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6332 7.4896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5575 9.1850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8621 9.1093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 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 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 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 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 M END