0 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 8.27962 6.85412 9.29529 11.4878 6.33889 7.2199 5.80437 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 11.4878 6.33889 7.2199 8.27962 6.85412 9.29529 5.80437 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.57077 6.33889 11.4878 5.60154 8.47421 7.2199 4.61049 12.6047 6.9513 6.27573 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.57077 6.33889 11.4878 5.60154 8.47421 7.2199 6.64015 14.9473 9.16116 11.1737 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 8.57077 6.33889 11.4878 5.60154 8.47421 7.2199 13.7377 16.8226 8.47109 10.9842 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 7.58835 9.20119 6.89191 5.67689 6.34173 8.59109 16.2375 14.4997 8.13782 14.5783 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 7.32874 6.40841 6.75888 4.55117 8.26899 8.80108 5.64209 11.3177 6.50297 7.57085 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 6.86465 8.63333 6.47744 5.92889 9.58673 7.01363 10.6476 12.4575 6.96494 6.49184 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 6.62496 9.58673 10.2241 4.67832 9.64665 13.848 6.47744 11.5023 7.01363 9.45755 numMergedOcc 0
9 mol 58 unq 3 iso 0 dist 6.35756 8.89374 6.47744 7.05413 9.58673 7.01363 12.7331 12.4575 6.96494 6.49184 numMergedOcc 0
10 mol 58 unq 4 iso 0 dist 9.55426 8.26899 10.3782 13.1021 9.73139 12.8396 6.75888 6.31428 8.80108 6.44201 numMergedOcc 0
11 mol 58 unq 5 iso 0 dist 9.55426 9.73139 13.1021 10.3782 8.26899 12.8396 7.02095 11.3177 6.96494 7.57085 numMergedOcc 0
12 mol 58 unq 6 iso 0 dist 9.55426 9.73139 13.1021 10.3782 8.26899 12.8396 8.94672 16.3779 7.01363 14.0155 numMergedOcc 0
13 mol 58 unq 7 iso 0 dist 9.55426 6.31428 6.75888 10.3782 8.26899 8.80108 7.02095 11.3177 6.50297 7.57085 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 9.96708 7.321 9.0131 7.11552 6.77912 9.19459 7.17489 10.4676 8.59747 4.64409 numMergedOcc 0
15 mol 72 unq 1 iso 0 dist 9.78528 7.321 6.11922 11.6894 9.02278 13.4823 7.11552 11.9814 9.19459 15.2764 numMergedOcc 0
16 mol 72 unq 2 iso 0 dist 9.78528 7.321 6.11922 11.6894 9.02278 13.4823 7.17489 13.3943 8.59747 17.8232 numMergedOcc 0
17 mol 88 unq 0 iso 0 dist 9.36773 8.66514 8.4283 6.95868 9.2603 13.649 5.90098 9.15979 7.71582 10.669 numMergedOcc 0
18 mol 88 unq 1 iso 0 dist 9.36773 9.25235 5.37521 6.95868 9.2603 12.48 5.90098 9.15979 6.65776 10.669 numMergedOcc 0
19 mol 115 unq 0 iso 0 dist 9.33865 7.76729 10.7942 6.09023 9.66954 12.4065 6.34759 12.0409 7.99631 7.34179 numMergedOcc 0
20 mol 115 unq 1 iso 0 dist 9.33865 7.76729 10.7942 6.09023 9.66954 12.4065 10.2377 7.64585 6.40036 12.0796 numMergedOcc 0
21 mol 115 unq 2 iso 0 dist 9.33865 7.76729 10.7942 10.2377 7.64585 6.40036 6.34759 12.0409 7.99631 9.37623 numMergedOcc 0
22 mol 115 unq 3 iso 0 dist 5.83991 7.76729 10.9739 6.09023 8.66155 12.4065 6.34759 11.8557 7.99631 7.34179 numMergedOcc 0
23 mol 115 unq 4 iso 0 dist 5.83991 7.76729 10.9739 6.09023 8.66155 12.4065 10.2377 12.2309 6.40036 12.0796 numMergedOcc 0
24 mol 115 unq 5 iso 0 dist 6.11741 7.64585 10.8939 10.8292 6.99777 17.3282 10.7942 12.9821 6.40036 19.687 numMergedOcc 0
25 mol 115 unq 6 iso 0 dist 6.11741 7.64585 10.8939 6.12943 9.14376 12.1188 10.7942 12.9821 6.40036 12.4207 numMergedOcc 0
26 mol 127 unq 0 iso 0 dist 9.30299 9.81878 4.77464 13.1312 7.34519 11.7518 14.085 8.59981 6.3244 12.7129 numMergedOcc 0
27 mol 155 unq 0 iso 0 dist 6.23493 9.17284 4.9093 5.86939 9.86313 10.3514 6.3845 7.16254 6.51096 7.63368 numMergedOcc 0
28 mol 155 unq 1 iso 0 dist 6.23493 7.16254 6.3845 4.9093 9.17284 6.51096 10.7896 13.2459 8.73171 6.0706 numMergedOcc 0
29 mol 155 unq 2 iso 0 dist 6.23493 9.86313 5.86939 4.9093 9.17284 10.3514 13.5062 12.1081 7.37901 12.644 numMergedOcc 0
30 mol 155 unq 3 iso 0 dist 7.46303 9.17284 6.3437 5.86939 7.51198 10.3514 6.3845 9.14392 6.51096 7.63368 numMergedOcc 0
31 mol 155 unq 4 iso 0 dist 7.46303 9.14392 6.3845 6.3437 9.17284 6.51096 9.99927 13.2459 8.73171 6.0706 numMergedOcc 0
32 mol 155 unq 5 iso 0 dist 7.46303 7.51198 5.86939 6.3437 9.17284 10.3514 8.27726 12.1081 7.37901 12.644 numMergedOcc 0
33 mol 155 unq 6 iso 0 dist 6.43582 7.36102 8.27726 12.1814 9.14392 13.2154 6.34186 7.51198 7.37901 7.63368 numMergedOcc 0
34 mol 155 unq 7 iso 0 dist 6.43582 9.14392 12.1814 12.8482 9.38946 18.2998 6.3437 12.2465 6.51096 18.0659 numMergedOcc 0
35 mol 155 unq 8 iso 0 dist 6.43582 9.14392 12.1814 12.8482 9.38946 18.2998 9.99927 15.1841 8.73171 18.0303 numMergedOcc 0
36 mol 155 unq 9 iso 0 dist 6.43582 9.14392 12.1814 8.27726 7.36102 13.2154 6.3437 12.2465 6.51096 12.644 numMergedOcc 0
37 mol 155 unq 10 iso 0 dist 6.43582 9.14392 12.1814 8.27726 7.36102 13.2154 9.99927 15.1841 8.73171 12.3927 numMergedOcc 0
38 mol 155 unq 11 iso 0 dist 6.43582 7.51198 6.34186 12.8482 9.38946 11.3251 8.27726 7.36102 7.37901 5.68272 numMergedOcc 0
39 mol 175 unq 0 iso 0 dist 5.6234 9.8589 10.5631 5.28109 9.0664 12.8738 11.0415 12.816 4.79852 12.0428 numMergedOcc 0
40 mol 175 unq 1 iso 0 dist 9.92231 7.24908 10.5631 7.14477 9.0664 12.8738 5.0384 12.816 4.79852 12.0428 numMergedOcc 0
41 mol 181 unq 0 iso 0 dist 5.98885 6.94688 5.86342 5.4601 7.20046 10.5561 8.25067 10.8351 8.20656 13.6811 numMergedOcc 0
42 mol 181 unq 1 iso 0 dist 5.98885 6.94688 5.86342 10.0524 7.13543 11.7007 8.25067 10.8351 8.20656 17.3245 numMergedOcc 0
43 mol 181 unq 2 iso 0 dist 5.98885 6.71012 9.14057 5.4601 7.20046 9.94131 8.25067 10.8351 9.40622 13.6811 numMergedOcc 0
44 mol 181 unq 3 iso 0 dist 5.98885 6.71012 9.14057 10.0524 7.13543 12.8673 8.25067 10.8351 9.40622 17.3245 numMergedOcc 0
45 mol 181 unq 4 iso 0 dist 9.15386 9.6668 8.25067 6.80228 6.94688 8.20656 11.6919 6.71012 9.40622 5.3528 numMergedOcc 0
46 mol 181 unq 5 iso 0 dist 9.15386 9.6668 8.25067 11.6919 6.71012 9.40622 6.80228 6.94688 8.20656 5.3528 numMergedOcc 0
47 mol 224 unq 0 iso 0 dist 8.95269 6.87664 7.98696 9.36098 7.06793 8.89778 5.29877 6.67585 9.47554 6.88258 numMergedOcc 0
48 mol 224 unq 1 iso 0 dist 8.95269 6.87664 7.98696 5.29877 6.67585 9.47554 9.36098 7.06793 8.89778 6.88258 numMergedOcc 0
49 mol 224 unq 2 iso 0 dist 6.57273 6.87664 7.12232 5.29877 6.65984 9.47554 9.36098 10.0414 8.89778 6.88258 numMergedOcc 0
50 mol 235 unq 0 iso 0 dist 5.4638 8.21247 4.65302 9.66021 9.58736 11.9287 10.6981 10.7117 7.27958 15.6642 numMergedOcc 0
51 mol 239 unq 0 iso 0 dist 7.00034 7.20082 7.04058 5.39146 8.1777 9.95595 6.26168 7.39747 6.34801 4.89061 numMergedOcc 0
