0 mol 8 unq 0 iso 0 dist 8.96553 9.62879 8.4069 4.41134 5.89134 10.4604 7.12261 12.536 9.01112 10.2357 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.86014 8.86116 10.0952 7.72775 9.61998 15.8896 11.6226 16.0162 8.09311 17.6018 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.86014 8.86116 10.0952 7.72775 9.61998 15.8896 13.1949 16.8554 9.05357 20.8013 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.20293 5.73819 5.06502 5.54797 6.79185 8.92291 5.07458 10.0168 6.66407 10.0882 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.93915 5.73819 5.89973 5.54797 8.37962 8.92291 5.07458 10.9975 6.66407 10.0882 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.96708 9.78528 8.24309 4.45372 8.96978 11.4456 7.47371 7.12321 6.21799 6.82436 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 9.96708 9.78528 8.24309 4.45372 8.96978 11.4456 9.67587 9.35457 5.03251 9.981 numMergedOcc 0
7 mol 72 unq 2 iso 0 dist 9.96708 9.78528 8.24309 4.45372 8.96978 11.4456 7.07356 12.1131 7.66093 8.73067 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 7.9151 9.33919 9.79143 6.20232 12.2276 8.68662 12.8099 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 7.9151 9.33919 9.79143 5.70116 9.73086 7.4369 10.4668 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.96396 8.70481 14.9342 7.9151 9.33919 6.43377 11.2069 13.3207 5.5087 4.25755 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 9.96396 8.70481 14.9342 7.9151 9.33919 6.43377 10.6713 14.498 6.08682 6.08046 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 6.19304 9.96396 5.4148 7.9151 9.79143 9.33919 5.70116 7.4369 9.73086 10.4668 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 6.19304 8.70481 13.3558 7.9151 9.79143 6.43377 11.2069 13.8368 5.5087 4.25755 numMergedOcc 0
14 mol 73 unq 6 iso 0 dist 6.19304 8.70481 13.3558 7.9151 9.79143 6.43377 10.6713 14.5999 6.08682 6.08046 numMergedOcc 0
15 mol 73 unq 7 iso 0 dist 8.70481 9.96396 14.9342 7.9151 6.43377 9.33919 5.70116 12.8207 9.73086 10.4668 numMergedOcc 0
16 mol 73 unq 8 iso 0 dist 8.70481 6.19304 13.3558 7.9151 6.43377 9.79143 6.20232 13.8931 8.68662 12.8099 numMergedOcc 0
17 mol 73 unq 9 iso 0 dist 8.70481 6.19304 13.3558 7.9151 6.43377 9.79143 5.70116 12.8207 7.4369 10.4668 numMergedOcc 0
18 mol 88 unq 0 iso 0 dist 8.31336 9.36773 5.57085 6.81076 9.36032 6.066 12.1193 12.785 7.80898 6.29943 numMergedOcc 0
19 mol 100 unq 0 iso 0 dist 7.17106 9.60661 11.5403 8.07089 8.20656 12.5743 4.03277 10.5432 8.91882 8.59989 numMergedOcc 0
20 mol 100 unq 1 iso 0 dist 9.35224 9.60661 7.80879 6.35939 7.5951 10.8753 4.03277 11.5088 8.91882 8.30652 numMergedOcc 0
21 mol 100 unq 2 iso 0 dist 6.56369 7.47343 12.6515 4.46114 7.5951 10.653 5.9143 10.694 7.82475 4.89471 numMergedOcc 0
22 mol 100 unq 3 iso 0 dist 6.56369 7.47343 12.6515 4.46114 7.5951 10.653 5.47563 9.82522 5.35782 6.75232 numMergedOcc 0
23 mol 100 unq 4 iso 0 dist 6.56369 6.65086 7.80879 4.46114 7.5951 10.8753 6.23008 11.5088 8.91882 8.30652 numMergedOcc 0
24 mol 117 unq 0 iso 0 dist 7.90328 7.83136 7.22206 11.1062 8.2236 11.3487 3.55765 10.4223 8.19331 11.7842 numMergedOcc 0
25 mol 117 unq 1 iso 0 dist 7.90328 7.0603 9.3584 11.1062 8.2236 15.9037 3.55765 10.4223 8.85711 11.7842 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 7.11802 8.00618 8.18495 6.56917 9.64695 4.51266 15.0115 12.5855 8.77023 13.2024 numMergedOcc 0
27 mol 178 unq 0 iso 0 dist 7.17202 6.69288 11.7381 6.39077 7.12045 12.5736 6.42973 13.2692 7.06025 9.97415 numMergedOcc 0
28 mol 178 unq 1 iso 0 dist 8.81551 6.69288 14.0703 6.39077 8.94945 12.5736 6.42973 15.0672 7.06025 9.97415 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 6.56247 9.45496 5.88703 8.83842 7.72403 6.35438 12.4252 11.6391 7.81215 4.76962 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 9.36357 6.7625 5.88703 5.43327 7.72403 6.35438 5.75498 11.6391 7.81215 4.76962 numMergedOcc 0
31 mol 248 unq 0 iso 0 dist 7.21521 7.69895 5.55137 5.41499 9.12664 12.1448 4.58289 9.33962 9.05018 7.78823 numMergedOcc 0
32 mol 248 unq 1 iso 0 dist 8.2965 7.69895 10.8081 5.41499 6.51383 12.1448 4.58289 11.4547 9.05018 7.78823 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 7.88519 8.13497 4.69778 10.1317 7.64122 11.9769 8.8603 7.66153 9.07743 11.464 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 9.01049 6.92774 7.03728 11.528 9.82018 13.4222 5.75897 13.2256 9.21786 13.1551 numMergedOcc 0
