MMs03072049 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -1.2958 -0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8938 -0.7670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2027 1.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5050 2.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8007 1.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4919 -0.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0899 -0.7897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3988 1.4546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1030 2.2103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7011 2.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9968 1.4433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2991 2.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3057 3.6876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0099 4.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7076 3.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4119 4.4546 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -15.5949 1.4319 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.0834 -2.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3791 -3.0453 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0366 0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5204 -1.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0631 -1.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8307 0.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3734 0.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1185 -1.6829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6611 -1.6896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 2.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5102 3.4216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4866 -1.9783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4288 -0.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9916 0.2433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3475 4.2830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0151 5.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7811 -3.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 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 1 0 0 0 0 23 24 1 0 0 0 0 23 41 2 0 0 0 0 M CHG 1 24 -1 M END