MMs01337520 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 58 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 1.2589 0.8156 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2589 -0.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6587 0.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6039 1.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 1.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7844 2.8538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9688 4.1127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4708 4.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7884 2.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 2.3134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1744 3.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4106 4.7400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2266 2.7227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3913 3.6679 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7922 3.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0494 3.9503 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2161 3.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6974 3.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6426 2.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1066 0.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6253 0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6801 1.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1821 1.6835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1239 2.3154 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.8876 3.7967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3602 0.8341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6052 2.5517 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5504 1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0317 1.6233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9770 0.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4410 -0.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9597 -1.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0144 -0.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3862 -2.1070 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6525 1.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0071 -0.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6525 -1.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1127 -0.7921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6644 -0.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7544 0.5109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9828 2.9153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5148 5.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8183 5.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6097 1.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1331 1.9364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1262 4.3646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8628 -0.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1965 -0.6789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0340 3.6725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4605 2.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1620 0.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5309 -2.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8294 -0.2030 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 11 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M END