MMs00029691 MOE2007 2D CORINA 3.40 0006 02.08.2006 68 71 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 0.9893 -1.1275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6587 -2.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -3.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0755 -2.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -0.9898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2496 0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5163 1.6080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7495 0.2803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6155 -0.9445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0479 -0.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0671 1.0006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1064 0.4006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6466 1.4824 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4951 2.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2014 2.9148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7383 3.2455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2193 4.0166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 5.4490 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9332 5.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 5.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8658 7.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4453 7.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4645 9.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8969 9.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 8.4142 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 6.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2551 6.2201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3468 7.9831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2919 1.8667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6543 1.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7919 -0.2546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8790 2.1051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2414 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3790 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7414 -0.6438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9661 0.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8285 1.7159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4661 2.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0532 2.5820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.4156 1.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 0.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7915 0.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4437 -3.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0581 -4.5521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -2.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5687 -1.5311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0895 -2.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2824 -1.6761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2429 -0.3891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3898 3.7521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2538 4.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1206 5.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4655 7.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5028 9.9114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2823 10.7753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1611 8.8646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7616 8.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1817 3.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7689 3.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3993 -0.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8515 -1.8387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0561 -0.2798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3560 3.5385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9135 0.8645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5055 1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9177 3.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 5 6 2 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 37 38 2 0 0 0 0 37 64 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 39 65 1 0 0 0 0 40 41 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 41 68 1 0 0 0 0 M END