0 mol 7 unq 0 iso 0 dist 9.60499 7.5706 10.5551 9.0379 10.6581 6.28925 13.2603 15.9584 7.58143 6.36911 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.60499 7.5706 10.5551 15.4949 18.3807 8.70159 13.1631 18.8575 8.50789 7.31201 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.60499 7.5706 10.5551 15.4949 18.3807 8.70159 13.2603 15.9584 7.58143 9.36807 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.41585 6.28925 10.6847 13.2247 12.2333 8.70159 10.672 12.2708 8.50789 7.31201 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 8.41585 6.28925 10.6847 13.2247 12.2333 8.70159 6.36911 6.06176 7.58143 9.36807 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.10621 8.70159 4.87279 13.2247 10.5461 6.28925 9.36807 10.515 7.58143 6.36911 numMergedOcc 0
6 mol 15 unq 0 iso 0 dist 8.38064 7.876 5.88545 5.17568 10.4158 8.63502 10.2713 5.01321 5.3298 9.78051 numMergedOcc 0
7 mol 15 unq 1 iso 0 dist 9.97507 7.876 8.20465 5.17568 6.82505 8.63502 10.2713 5.55659 5.3298 9.78051 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 5.73819 8.92291 5.54797 5.06502 6.20293 6.79185 13.5377 9.49077 6.17433 9.83618 numMergedOcc 0
9 mol 43 unq 1 iso 0 dist 8.93915 8.37962 5.54797 6.45462 6.20293 6.79185 13.7177 9.49077 6.17433 9.83618 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 9.38498 9.33919 15.9091 5.4148 10.2049 9.79143 8.70133 13.4082 13.2106 4.65521 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 9.96396 9.33919 7.9151 5.4148 6.19304 9.79143 8.70133 7.41074 13.2106 4.65521 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 6.19304 9.79143 7.9151 5.4148 9.96396 9.33919 4.65521 7.41074 13.2106 8.70133 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 8.70481 6.43377 7.9151 14.9342 9.96396 9.33919 15.9587 7.41074 13.2106 8.70133 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 8.70481 6.43377 7.9151 13.3558 6.19304 9.79143 15.9587 7.41074 13.2106 4.65521 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 9.75218 9.33919 5.44172 5.4148 11.6369 9.79143 8.70133 15.9882 13.2106 4.65521 numMergedOcc 0
16 mol 85 unq 0 iso 0 dist 7.97049 9.30021 10.4545 6.9948 7.47541 5.62635 9.47876 7.98917 4.59398 7.22293 numMergedOcc 0
17 mol 85 unq 1 iso 0 dist 7.47541 5.62635 10.4545 6.9948 7.97049 9.30021 7.22293 7.98917 4.59398 9.47876 numMergedOcc 0
18 mol 85 unq 2 iso 0 dist 6.19965 9.30021 12.3178 6.9948 7.66905 5.62635 9.47876 11.6116 4.59398 7.22293 numMergedOcc 0
19 mol 85 unq 3 iso 0 dist 7.66905 5.62635 12.3178 6.9948 6.19965 9.30021 7.22293 11.6116 4.59398 9.47876 numMergedOcc 0
20 mol 85 unq 4 iso 0 dist 5.73196 5.62635 7.43006 6.9948 11.2656 9.30021 7.22293 6.47779 4.59398 9.47876 numMergedOcc 0
21 mol 88 unq 0 iso 0 dist 8.31336 9.36032 6.81076 5.57085 9.36773 6.066 10.6733 8.4283 7.39092 8.66514 numMergedOcc 0
22 mol 88 unq 1 iso 0 dist 8.31336 9.36032 6.81076 5.57085 9.36773 6.066 8.69012 5.37521 8.30564 9.25235 numMergedOcc 0
23 mol 127 unq 0 iso 0 dist 8.14887 5.72373 10.2773 5.55757 12.8743 7.20988 8.59981 14.9761 4.98036 7.66331 numMergedOcc 0
24 mol 127 unq 1 iso 0 dist 8.14887 5.72373 10.2773 5.55757 12.8743 7.20988 7.34519 7.41404 8.57565 8.58999 numMergedOcc 0
25 mol 127 unq 2 iso 0 dist 9.30299 5.72373 10.7123 5.55757 14.7391 7.20988 8.59981 14.085 4.98036 7.66331 numMergedOcc 0
26 mol 127 unq 3 iso 0 dist 9.30299 5.72373 10.7123 5.55757 14.7391 7.20988 7.34519 13.1312 8.57565 8.58999 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 9.0018 5.08591 8.19969 6.2715 5.6234 8.03727 10.689 5.28109 7.15144 9.0664 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 7.652 5.08591 5.33769 6.2715 9.92231 8.03727 10.689 7.14477 7.15144 9.0664 numMergedOcc 0
29 mol 175 unq 2 iso 0 dist 5.6234 8.03727 8.19969 6.2715 9.0018 5.08591 12.816 11.0415 9.19032 9.31887 numMergedOcc 0
30 mol 175 unq 3 iso 0 dist 9.92231 8.03727 5.33769 6.2715 7.652 5.08591 12.816 5.0384 9.19032 9.31887 numMergedOcc 0
31 mol 234 unq 0 iso 0 dist 8.34494 7.72403 10.3378 5.88703 12.9605 6.35438 10.3388 15.6589 10.0213 9.5707 numMergedOcc 0
32 mol 234 unq 1 iso 0 dist 8.34494 7.72403 10.3378 5.88703 12.9605 6.35438 6.25105 10.3337 6.81789 7.85175 numMergedOcc 0
33 mol 234 unq 2 iso 0 dist 8.34494 7.72403 10.3378 15.2225 19.889 9.57132 11.6207 12.8998 5.16504 9.39181 numMergedOcc 0
34 mol 234 unq 3 iso 0 dist 6.56247 7.72403 8.83842 5.88703 9.45496 6.35438 10.3388 15.9563 10.0213 9.5707 numMergedOcc 0
35 mol 234 unq 4 iso 0 dist 6.56247 7.72403 8.83842 5.88703 9.45496 6.35438 6.25105 11.216 6.81789 7.85175 numMergedOcc 0
36 mol 234 unq 5 iso 0 dist 6.56247 7.72403 8.83842 15.2225 17.458 9.57132 11.6207 13.3898 5.16504 9.39181 numMergedOcc 0
37 mol 234 unq 6 iso 0 dist 9.36357 7.72403 5.43327 5.88703 6.7625 6.35438 10.3388 14.4106 10.0213 9.5707 numMergedOcc 0
38 mol 234 unq 7 iso 0 dist 9.36357 7.72403 5.43327 5.88703 6.7625 6.35438 6.25105 11.4315 6.81789 7.85175 numMergedOcc 0
39 mol 234 unq 8 iso 0 dist 9.36357 7.72403 5.43327 15.2225 10.701 9.57132 11.6207 10.0607 5.16504 9.39181 numMergedOcc 0
40 mol 234 unq 9 iso 0 dist 9.45496 6.35438 8.83842 5.88703 6.56247 7.72403 7.85175 11.216 6.81789 6.25105 numMergedOcc 0
41 mol 234 unq 10 iso 0 dist 9.45496 6.35438 8.83842 10.2693 17.458 9.57132 10.475 13.3898 5.16504 9.39181 numMergedOcc 0
42 mol 234 unq 11 iso 0 dist 6.7625 6.35438 5.43327 5.88703 9.36357 7.72403 7.85175 11.4315 6.81789 6.25105 numMergedOcc 0
43 mol 234 unq 12 iso 0 dist 6.7625 6.35438 5.43327 10.2693 10.701 9.57132 10.475 10.0607 5.16504 9.39181 numMergedOcc 0
44 mol 274 unq 0 iso 0 dist 7.56915 6.32856 11.5556 9.15171 13.9359 8.11169 14.4588 19.9909 13.4431 6.50589 numMergedOcc 0
45 mol 274 unq 1 iso 0 dist 8.49997 6.32856 13.5073 9.15171 17.2858 8.11169 14.4588 22.6465 13.4431 6.50589 numMergedOcc 0
