0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 15.8072 8.72114 10.7937 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.46102 3.69663 4.92734 10.4489 8.53529 7.97177 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.91301 11.375 6.4754 10.4489 7.18019 5.3298 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.91301 3.69663 6.57999 10.4489 7.18019 7.97177 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 8.46229 6.21955 9.16444 9.93406 7.32257 5.86578 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.11056 8.95357 8.20058 11.095 8.60554 13.4836 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.11056 8.95357 8.20058 4.04757 8.44664 11.9824 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.11056 8.95357 8.20058 6.66757 9.44691 9.04355 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 8.88413 5.30126 6.22122 10.7087 7.55264 6.63966 numMergedOcc 0
9 mol 30 unq 0 iso 0 dist 8.609 4.64354 6.83481 5.73417 8.1284 5.2347 numMergedOcc 0
10 mol 41 unq 0 iso 0 dist 5.41493 6.19414 8.52313 4.08339 8.51663 8.06801 numMergedOcc 0
11 mol 56 unq 0 iso 0 dist 7.20538 8.39913 8.96238 3.63144 7.16773 4.936 numMergedOcc 0
12 mol 69 unq 0 iso 0 dist 9.8809 8.50061 7.62791 7.30649 9.97775 5.47666 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 9.3931 6.27454 9.00902 5.09984 5.73743 8.07487 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 5.9747 11.1108 8.05602 7.43001 6.65501 11.0132 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 4.50572 9.17639 8.05602 9.5305 6.65501 11.0132 numMergedOcc 0
16 mol 109 unq 0 iso 0 dist 8.3164 7.12319 8.84523 4.81814 7.80523 10.8869 numMergedOcc 0
17 mol 113 unq 0 iso 0 dist 8.89481 4.57112 9.08014 11.2266 8.8822 10.3234 numMergedOcc 0
18 mol 113 unq 1 iso 0 dist 8.89481 4.57112 9.08014 9.01097 9.66219 9.4626 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 6.40546 9.90172 7.85527 5.73999 8.99399 7.21894 numMergedOcc 0
20 mol 119 unq 1 iso 0 dist 5.63005 11.5865 8.62648 4.01593 6.52773 9.25614 numMergedOcc 0
21 mol 119 unq 2 iso 0 dist 5.63005 11.5865 8.62648 13.1254 9.23858 5.53673 numMergedOcc 0
22 mol 129 unq 0 iso 0 dist 6.38163 8.56696 6.23966 7.03404 6.28565 6.47522 numMergedOcc 0
23 mol 129 unq 1 iso 0 dist 6.38163 8.56696 6.23966 4.92611 7.58957 5.85167 numMergedOcc 0
24 mol 131 unq 0 iso 0 dist 7.81337 10.4143 8.99949 4.34786 8.70296 10.5805 numMergedOcc 0
25 mol 131 unq 1 iso 0 dist 7.81337 10.4143 8.99949 11.6607 9.25558 8.98062 numMergedOcc 0
26 mol 159 unq 0 iso 0 dist 7.97007 5.21344 7.47975 4.49716 9.17787 4.02361 numMergedOcc 0
27 mol 159 unq 1 iso 0 dist 7.97007 5.21344 7.47975 6.69743 8.4858 9.90351 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 9.58911 7.56512 6.58792 12.0718 6.22122 6.56225 numMergedOcc 0
29 mol 212 unq 0 iso 0 dist 5.87223 12.1126 9.47932 9.39384 9.74144 9.63106 numMergedOcc 0
30 mol 212 unq 1 iso 0 dist 5.87223 12.1126 9.47932 6.48939 8.69988 10.6561 numMergedOcc 0
31 mol 212 unq 2 iso 0 dist 5.87223 12.1126 9.47932 5.81626 8.55903 15.0782 numMergedOcc 0
32 mol 212 unq 3 iso 0 dist 5.87223 12.1126 9.47932 5.94698 7.15603 7.56072 numMergedOcc 0
33 mol 212 unq 4 iso 0 dist 8.062 4.95466 9.47932 4.69067 9.74144 9.63106 numMergedOcc 0
34 mol 212 unq 5 iso 0 dist 8.062 4.95466 9.47932 10.4595 8.69988 10.6561 numMergedOcc 0
35 mol 212 unq 6 iso 0 dist 8.062 4.95466 9.47932 14.0193 8.55903 15.0782 numMergedOcc 0
36 mol 212 unq 7 iso 0 dist 8.062 4.95466 9.47932 4.18086 7.15603 7.56072 numMergedOcc 0
37 mol 212 unq 8 iso 0 dist 8.70011 11.245 9.47932 5.37854 9.74144 9.63106 numMergedOcc 0
38 mol 212 unq 9 iso 0 dist 8.70011 11.245 9.47932 8.87823 8.69988 10.6561 numMergedOcc 0
39 mol 212 unq 10 iso 0 dist 8.70011 11.245 9.47932 10.7245 8.55903 15.0782 numMergedOcc 0
40 mol 212 unq 11 iso 0 dist 8.70011 11.245 9.47932 3.74692 7.15603 7.56072 numMergedOcc 0
41 mol 222 unq 0 iso 0 dist 9.55777 14.056 5.47561 12.979 7.67576 10.3328 numMergedOcc 0
42 mol 222 unq 1 iso 0 dist 9.55777 14.056 5.47561 4.05539 9.82371 15.0445 numMergedOcc 0
43 mol 232 unq 0 iso 0 dist 7.70279 5.18593 8.89211 6.36084 8.50102 7.46856 numMergedOcc 0
44 mol 239 unq 0 iso 0 dist 6.44212 10.5291 8.61729 8.28901 8.84636 5.66996 numMergedOcc 0
45 mol 274 unq 0 iso 0 dist 9.52894 9.82234 8.71129 6.70266 7.1729 4.48276 numMergedOcc 0
