MMs00717913 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 -0.0131 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2794 -2.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2663 -3.7612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0392 -4.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3317 -3.7385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3186 -2.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6111 -1.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9166 -2.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -1.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5146 -2.1933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8070 -1.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1125 -2.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4050 -1.4094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.7105 -2.1480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0030 -1.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3085 -2.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6009 -1.3641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5879 0.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2823 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9899 0.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6844 0.8519 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.3216 -3.6253 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0105 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3238 -1.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3003 -4.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0497 -5.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3761 -4.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1533 -3.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6959 -3.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 -3.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0277 -0.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5703 -0.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3492 -3.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8919 -3.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9472 -3.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4898 -3.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6454 -1.9550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6218 0.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2719 2.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 M END