MMs02234405 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -1.5000 0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4919 2.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0081 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 1.2921 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.3060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2459 -1.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7459 -1.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4919 -2.6213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9919 -2.6260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8773 -1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3025 -1.8832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2978 -3.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8698 -3.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5534 -5.3085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4110 -5.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 -6.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0930 -5.8565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4094 -4.3903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8374 -3.9312 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2379 3.9041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0140 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5968 -1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1032 -1.0327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6113 3.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8572 2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2953 1.1684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6289 0.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -1.7222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4507 -2.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5412 -0.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8748 -0.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -3.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6966 -3.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5101 -0.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4118 -7.4886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6347 4.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4919 2.6120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 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 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 2 0 0 0 0 M CHG 1 27 -1 M END