MMs02727844 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 60 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 -0.9933 -1.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4633 -0.8259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4566 -1.9499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9798 -3.3721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9266 -1.6517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0319 -2.6658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3379 -1.9279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7601 -2.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8842 -1.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5860 0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1638 0.5354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0398 -0.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5495 -0.2872 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 0.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0627 2.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9973 -0.2176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3744 -1.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2447 -2.8039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7379 -2.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3608 -1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4905 -0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0583 -3.8748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9343 -4.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2324 -6.3381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6546 -6.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7787 -5.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4805 -4.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9528 -8.2850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3750 -8.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8612 -4.1560 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5553 -4.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8534 -6.3640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3437 -6.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9665 -5.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8992 -0.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7946 0.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8992 0.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0303 -1.7504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4324 -2.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7464 -3.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4342 -3.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5553 -1.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9887 1.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7965 -4.4866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3332 -7.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9164 -6.2031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3797 -3.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7564 -7.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5127 -9.1433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9935 -9.8996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4636 -4.3956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0422 -7.2482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -7.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5546 -5.0508 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 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 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 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 35 2 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 M END