MMs01189394 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.2941 -0.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2843 -2.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5784 -3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8823 -2.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 -0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4902 -0.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4803 -2.2924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 1.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1078 2.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4019 1.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6764 -2.3264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0254 -0.6917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9999 1.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7058 2.1735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3038 2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5979 1.3981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 -0.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8822 -0.8604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1861 -0.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1959 1.3811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9018 2.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4803 -0.8773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7842 -0.1358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 -0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6068 1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0353 0.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6068 -1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2412 -2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5706 -4.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9176 -2.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 1.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2039 1.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6208 1.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4008 2.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3425 3.1148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8851 3.1047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5385 3.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0812 3.0708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5450 -0.6951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8744 -2.0603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2391 1.9743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9097 3.3396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3774 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8273 0.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1910 0.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3108 -1.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8535 -1.7337 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 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END