MMs03711599 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 1.3026 -0.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3097 -2.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6123 -2.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -2.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -0.7315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -0.2612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6904 0.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2124 -1.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3365 -2.6883 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7124 -1.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4686 -2.7589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9685 -2.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7124 -1.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2124 -1.4421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9685 -2.7376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2247 -4.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7247 -4.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9808 -5.3356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2370 -6.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4685 -2.7305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2123 -1.4279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7123 -1.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4685 -2.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9684 -2.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7123 -1.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9561 -0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4561 -0.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7000 1.1773 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.4562 -0.1609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2001 1.1417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5951 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 0.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2733 -2.8487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -4.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 1.2123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8735 -3.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1074 -0.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8074 -0.4001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1296 -5.0893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1949 -6.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6419 -7.6803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2790 -7.2333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0828 -1.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4151 -0.2452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8734 -3.7583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5734 -3.7455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9123 -1.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5512 0.9310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 31 32 3 0 0 0 0 M END