-ISIS- -- StrEd -- 34 37 0 0 0 0 0 0 0 0 0 -1.2849 0.8077 0.0000 N 0 0 0 0 0 0 0 0 0 -0.4216 1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4265 2.3121 0.0000 O 0 0 0 0 0 0 0 0 0 0.4417 0.8130 0.0000 C 0 0 0 0 0 0 0 0 0 0.4379 -0.1855 0.0000 C 0 0 0 0 0 0 0 0 0 1.2962 -0.6852 0.0000 N 0 0 0 0 0 0 0 0 0 1.3035 1.3120 0.0000 C 0 0 0 0 0 0 0 0 0 2.1671 0.8067 0.0000 C 0 0 0 0 0 0 0 0 0 2.1630 -0.1972 0.0000 C 0 0 0 0 0 0 0 0 0 3.0254 -0.6999 0.0000 C 0 0 0 0 0 0 0 0 0 3.8978 -0.2045 0.0000 C 0 0 0 0 0 0 0 0 0 3.9019 0.7991 0.0000 C 0 0 0 0 0 0 0 0 0 3.0337 1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 1.2921 -1.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0.4209 -2.1743 0.0000 C 0 0 0 0 0 0 0 0 0 0.4133 -3.1731 0.0000 C 0 0 0 0 0 0 0 0 0 1.2763 -3.6799 0.0000 C 0 0 0 0 0 0 0 0 0 2.1482 -3.1810 0.0000 C 0 0 0 0 0 0 0 0 0 2.1516 -2.1844 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4313 -0.6762 0.0000 O 0 0 0 0 0 0 0 0 0 3.0263 2.3121 0.0000 O 0 0 0 0 0 0 0 0 0 -2.1531 1.3074 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1519 2.3105 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0152 2.8102 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8849 2.3124 0.0000 N 0 0 0 0 0 0 0 0 0 -3.8861 1.3094 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0175 0.8042 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5209 3.6799 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3096 3.5238 0.0000 C 0 0 0 0 0 0 0 0 0 -4.8585 1.0554 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8947 0.3131 0.0000 C 0 0 0 0 0 0 0 0 0 3.0111 -3.6799 0.0000 Cl 0 0 0 0 0 0 0 0 0 4.8585 0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 4.3891 -1.0651 0.0000 C 0 0 0 0 0 0 0 0 0 16 17 2 0 0 0 0 2 4 1 0 0 0 0 17 18 1 0 0 0 0 4 5 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 6 14 1 0 0 0 0 5 20 2 0 0 0 0 2 3 2 0 0 0 0 13 21 2 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 4 7 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 12 13 1 0 0 0 0 24 28 1 0 0 0 0 5 6 1 0 0 0 0 24 29 1 0 0 0 0 6 9 1 0 0 0 0 26 30 1 0 0 0 0 14 15 2 0 0 0 0 26 31 1 0 0 0 0 8 7 1 0 0 0 0 18 32 1 0 0 0 0 15 16 1 0 0 0 0 11 33 1 0 0 0 0 8 9 2 0 0 0 0 11 34 1 0 0 0 0