MMs02487684 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 50 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 0.0127 -1.4999 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0215 -2.1087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0569 -2.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2927 0.7609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8906 0.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4886 0.8048 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4494 1.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8066 -1.4341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0866 0.8268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0878 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3919 1.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4046 -1.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7099 -2.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7226 -3.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0279 -4.3901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0406 -5.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7480 -6.6510 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7037 -6.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7581 -7.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6846 0.8487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 0.1098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2825 1.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8344 -0.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3771 -0.8908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1116 1.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 1.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4324 -0.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9751 -0.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0765 2.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2211 -1.2138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0037 -2.5432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1108 -1.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8934 -2.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5391 -3.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3217 -4.7821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0621 -3.7813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3053 0.7390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3155 1.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3395 0.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3459 -6.6290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3561 -7.8290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3801 -6.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6719 2.3487 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4759 2.3048 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6759 2.3149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4658 3.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 2.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 48 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 2 1 M CHG 1 21 1 M CHG 1 47 -1 M CHG 1 48 1 M END