MMs00663468 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7597 1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2596 1.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2402 -1.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7403 -1.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2402 -1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7401 -1.3493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 -0.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7595 1.2487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3672 2.2834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2595 1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5193 2.5644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0671 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7400 -1.3717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2400 -1.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1126 -2.6030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.5426 -2.1501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5538 -0.6502 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1307 -0.1760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7495 -3.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1243 -2.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3313 -3.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1633 -4.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7885 -5.4221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5816 -4.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4805 -2.6316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1674 2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8674 2.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8325 -2.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1326 -2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6094 -1.7737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9396 -2.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2587 -1.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4311 -2.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1289 -5.5348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6542 -6.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4817 -5.0113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0727 -3.6752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2805 -2.6226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END