MMs01019855 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 1.3676 -0.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5176 -2.1087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8852 -2.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1027 -1.8488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9526 -0.3563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 0.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 0.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5946 0.0499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4817 1.2594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6055 2.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1768 2.0198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0754 3.9014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9817 1.2527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7258 -0.0497 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 -1.3454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2258 -0.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9699 -1.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2141 -2.6545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4699 -1.3656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2141 -2.6680 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8141 -1.6288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4582 -3.9637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2024 -5.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7024 -5.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4582 -3.9772 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.0582 -5.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7141 -2.6748 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.9141 -2.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4699 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9582 -3.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 1.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 0.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -1.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5436 -2.8097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0052 -3.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1967 -2.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 1.4539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2150 3.5255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4514 5.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9359 4.2774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7786 2.4354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1112 1.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0228 1.1262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3553 0.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0746 -0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5425 -3.1882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5355 -4.7309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0729 -5.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4054 -6.4488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4887 -6.4537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8281 -5.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5064 -1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0746 -0.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4334 -0.7745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9528 -5.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1582 -3.9894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9636 -2.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 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 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 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 44 1 0 0 0 0 17 45 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 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END