AM1 EF PRECISE GNORM=0.05 NOINTER GRAPH Winmostar C 0 0 0 0 0 0 0 0 0 H 1.100024 1 0 0 0 0 1 0 0 C 1.546212 1 115.50036 1 0 0 1 2 0 N 1.422435 1 112.49154 1 133.2065 1 3 1 2 O 1.241623 1 122.22224 1 180.91344 1 1 2 3 Cl 1.796636 1 105.28358 1 256.37534 1 3 1 2 H 1.129944 1 111.6848 1 9.35158 1 3 1 2 H 0.997117 1 117.63497 1 39.9996 1 4 3 1 C 1.474396 1 121.90903 1 223.44882 1 4 3 1 C 1.546219 1 115.49991 1 180 1 9 4 3 N 1.422436 1 112.49127 1 133.20544 1 10 9 4 O 1.24162 1 122.22356 1 180.91258 1 9 4 10 Cl 1.796632 1 105.28395 1 256.37473 1 10 9 4 H 1.129937 1 111.6841 1 9.35109 1 10 9 4 H 0.99711 1 117.63544 1 40.00026 1 11 10 9 C 1.474411 1 121.90889 1 223.44868 1 11 10 9 C 1.546237 1 115.50022 1 180 1 16 11 10 N 1.42244 1 112.492 1 133.20523 1 17 16 11 O 1.241613 1 122.22356 1 180.91235 1 16 11 17 Cl 1.796638 1 105.28336 1 256.37497 1 17 16 11 H 1.129934 1 111.684 1 9.35123 1 17 16 11 H 0.99711 1 117.6348 1 40.0002 1 18 17 16 C 1.474403 1 121.90925 1 223.44914 1 18 17 16 C 1.546221 1 115.49998 1 180 1 23 18 17 N 1.42245 1 112.49178 1 133.20534 1 24 23 18 O 1.241614 1 122.22327 1 180.91214 1 23 18 24 Cl 1.796636 1 105.28361 1 256.37469 1 24 23 18 H 1.129938 1 111.68433 1 9.35109 1 24 23 18 H 0.997104 1 117.63422 1 39.99995 1 25 24 23 C 1.474403 1 121.90892 1 223.44897 1 25 24 23 C 1.546235 1 115.49944 1 180.01979 1 30 25 24 N 1.422443 1 112.49137 1 133.2054 1 31 30 25 O 1.241611 1 122.2239 1 180.91235 1 30 25 31 Cl 1.79663 1 105.28364 1 256.37473 1 31 30 25 H 1.129936 1 111.68436 1 9.35156 1 31 30 25 H 0.99711 1 117.63473 1 39.99987 1 32 31 30 C 1.474393 1 121.9091 1 223.44928 1 32 31 30 C 1.546235 1 115.50021 1 180.02797 1 37 32 31 N 1.422435 1 112.49189 1 133.20464 1 38 37 32 O 1.241616 1 122.22416 1 180.91129 1 37 32 38 Cl 1.796633 1 105.28343 1 256.3739 1 38 37 32 H 1.129936 1 111.68423 1 9.35066 1 38 37 32 H 0.997112 1 117.63447 1 40.00004 1 39 38 37 H 1.10001 1 121.90929 1 223.4485 1 39 38 37 C 20.821445 1 147.69031 1 52.26154 1 1 2 3 C 1.546222 1 26.55694 1 4.7503 1 45 1 2 N 1.422461 1 112.4919 1 14.2258 1 46 45 1 O 1.241612 1 107.44165 1 133.30139 1 45 1 2 Cl 1.79664 1 105.28333 1 137.39531 1 46 45 1 H 1.129941 1 111.6844 1 250.37146 1 46 45 1 H 0.997102 1 117.63471 1 39.99998 1 47 46 45 C 1.474402 1 121.90907 1 223.4487 1 47 46 45 H 1.100002 1 119.99982 1 180 1 45 46 48 C 1.546227 1 115.49974 1 180 1 52 47 46 N 1.422436 1 112.492 1 133.20541 1 54 52 47 O 1.241629 1 122.22368 1 180.91299 1 52 47 54 Cl 1.796646 1 105.28357 1 256.375 1 54 52 47 H 1.129946 1 111.68461 1 9.35101 1 54 52 47 H 0.997114 1 117.63451 1 40.0002 1 55 54 52 C 1.474403 1 121.90949 1 223.44894 1 55 54 52 C 1.546221 1 115.49995 1 180.02797 1 60 55 54 N 1.422445 1 112.49141 1 133.2057 1 61 60 55 O 1.241616 1 122.22283 1 180.9128 1 60 55 61 Cl 1.796638 1 105.28347 1 256.37466 1 61 60 55 H 1.129941 1 111.68456 1 9.35109 1 61 60 55 H 0.997099 1 117.63506 1 39.99968 1 62 61 60 C 1.474409 1 121.90882 1 223.44861 1 62 61 60 C 1.546224 1 115.49989 1 180.03427 1 67 62 61 N 1.422448 1 112.49168 1 133.20563 1 68 67 62 O 1.241623 1 122.22335 1 180.91299 1 67 62 68 Cl 1.796638 1 105.28357 1 256.37479 1 68 67 62 H 1.129936 1 111.68421 1 9.35112 1 68 67 62 H 0.997099 1 117.63425 1 39.99949 1 69 68 67 C 1.474393 1 121.90837 1 223.44917 1 69 68 67 C 1.546235 1 115.49892 1 179.98021 1 74 69 68 N 1.422452 1 112.49152 1 133.20544 1 75 74 69 O 1.241612 1 122.22409 1 180.91214 1 74 69 75 Cl 1.796631 1 105.28331 1 256.37427 1 75 74 69 H 1.129933 1 111.68417 1 9.35107 1 75 74 69 H 0.997114 1 117.63463 1 39.99968 1 76 75 74 C 1.474402 1 121.90894 1 223.44876 1 76 75 74 C 1.546219 1 115.49931 1 180 1 81 76 75 N 1.422449 1 112.49107 1 133.20534 1 82 81 76 O 1.241608 1 122.22378 1 180.91299 1 81 76 82 Cl 1.796627 1 105.28393 1 256.37442 1 82 81 76 H 1.129944 1 111.68418 1 9.35169 1 82 81 76 H 0.997113 1 117.63486 1 40.00099 1 83 82 81 H 1.099997 1 121.90921 1 223.44955 1 83 82 81