MMs00512947 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 -0.7412 -1.3041 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0176 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2411 -1.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9823 -2.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4823 -2.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2411 -1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7410 -1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 -0.0508 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7586 1.2533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5174 2.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0102 2.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 4.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0381 4.9177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9166 3.9216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7586 1.2330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7410 -1.3651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2409 -1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9997 -0.0813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4997 -0.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2409 -1.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4821 -2.6895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9821 -2.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2233 -3.9936 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0433 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5929 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0175 -3.2050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6246 -3.6332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0527 -1.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3753 -3.6535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0752 -3.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1069 1.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 1.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5247 -2.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8659 -1.7628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8342 0.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8446 2.0308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8071 1.7967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4316 4.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9208 6.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1339 -2.4002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4068 0.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1067 0.9437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4408 -1.4037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3751 -3.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 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 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 49 1 0 0 0 0 M END