0 mol 43 unq 0 iso 0 dist 8.83248 9.15042 10.6711 9.467 5.13123 6.71084 10.3387 8.84944 14.9221 10.7067 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.0009 8.93949 4.76091 8.81795 8.73619 4.65281 6.74022 8.52643 9.95118 11.058 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 8.0009 8.93949 4.76091 8.81795 8.73619 4.65281 5.42653 9.75299 12.2237 13.1776 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 8.91298 8.93949 6.13923 8.81795 8.70732 4.65281 6.74022 5.41357 9.95118 11.058 numMergedOcc 0
4 mol 64 unq 3 iso 0 dist 8.91298 8.93949 6.13923 8.81795 8.70732 4.65281 5.42653 9.30042 12.2237 13.1776 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 5.72494 5.94478 6.07628 8.68825 11.8761 6.80288 5.40051 7.66418 10.9047 13.4182 numMergedOcc 0
6 mol 103 unq 1 iso 0 dist 8.70106 5.94478 10.2138 8.68825 13.2825 6.80288 5.40051 8.078 10.9047 13.4182 numMergedOcc 0
7 mol 103 unq 2 iso 0 dist 8.70106 5.94478 10.2138 8.68825 13.2825 6.80288 14.0531 6.56481 16.4062 17.8758 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 7.14447 9.0339 11.6877 8.2746 8.17517 10.7352 9.07803 9.39389 12.625 15.7222 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 7.14447 8.48641 11.8999 8.2746 8.17517 7.99849 9.07803 9.39389 14.9674 15.7222 numMergedOcc 0
10 mol 132 unq 2 iso 0 dist 7.14447 6.23573 5.77316 8.2746 8.17517 6.71037 9.07803 9.39389 12.4587 15.7222 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 8.60157 9.7168 5.77745 9.69869 8.92915 11.6053 6.76353 8.6953 12.9544 10.8341 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 8.60157 9.7168 5.77745 4.7785 6.43817 6.84291 6.76353 8.6953 12.9544 9.21934 numMergedOcc 0
13 mol 148 unq 2 iso 0 dist 8.60157 7.38138 11.2162 9.69869 8.92915 12.2257 6.76353 8.6953 13.8436 10.8341 numMergedOcc 0
14 mol 148 unq 3 iso 0 dist 8.60157 7.38138 11.2162 4.7785 6.43817 6.29254 6.76353 8.6953 13.8436 9.21934 numMergedOcc 0
15 mol 148 unq 4 iso 0 dist 6.72591 9.7168 12.9245 9.69869 5.27089 11.6053 6.76353 9.18753 12.9544 10.8341 numMergedOcc 0
16 mol 148 unq 5 iso 0 dist 6.72591 9.7168 12.9245 4.7785 6.16168 6.84291 6.76353 9.18753 12.9544 9.21934 numMergedOcc 0
17 mol 148 unq 6 iso 0 dist 6.72591 7.38138 10.5987 9.69869 5.27089 12.2257 6.76353 9.18753 13.8436 10.8341 numMergedOcc 0
18 mol 148 unq 7 iso 0 dist 6.72591 7.38138 10.5987 4.7785 6.16168 6.29254 6.76353 9.18753 13.8436 9.21934 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.59359 9.61132 5.71213 9.67177 8.91101 11.5258 6.65519 8.65967 12.8058 10.6874 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 8.59359 9.61132 5.71213 4.79493 6.48058 6.79619 6.65519 8.65967 12.8058 9.13113 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 8.59359 7.34423 11.2566 9.67177 8.91101 12.1369 6.65519 8.65967 13.7265 10.6874 numMergedOcc 0
22 mol 150 unq 3 iso 0 dist 8.59359 7.34423 11.2566 4.79493 6.48058 6.25747 6.65519 8.65967 13.7265 9.13113 numMergedOcc 0
23 mol 150 unq 4 iso 0 dist 6.80192 9.61132 12.8684 9.67177 5.24014 11.5258 6.65519 9.15244 12.8058 10.6874 numMergedOcc 0
24 mol 150 unq 5 iso 0 dist 6.80192 9.61132 12.8684 4.79493 6.14967 6.79619 6.65519 9.15244 12.8058 9.13113 numMergedOcc 0
25 mol 150 unq 6 iso 0 dist 6.80192 7.34423 10.4881 9.67177 5.24014 12.1369 6.65519 9.15244 13.7265 10.6874 numMergedOcc 0
26 mol 150 unq 7 iso 0 dist 6.80192 7.34423 10.4881 4.79493 6.14967 6.25747 6.65519 9.15244 13.7265 9.13113 numMergedOcc 0
27 mol 187 unq 0 iso 0 dist 5.26804 7.68247 4.98423 9.25461 8.43209 6.62321 6.31943 5.58167 6.82787 12.2628 numMergedOcc 0
28 mol 187 unq 1 iso 0 dist 5.26804 7.68247 4.98423 9.25461 8.43209 6.62321 8.33762 8.0501 12.7503 12.9656 numMergedOcc 0
29 mol 189 unq 0 iso 0 dist 9.71306 9.58744 11.7613 7.17249 13.8163 5.59904 7.19635 9.95686 16.0403 14.3276 numMergedOcc 0
30 mol 189 unq 1 iso 0 dist 9.71306 9.58744 11.7613 7.17249 13.8163 5.59904 8.18227 9.47321 11.5748 10.5796 numMergedOcc 0
31 mol 189 unq 2 iso 0 dist 9.20296 9.58744 6.36139 7.17249 8.33972 5.59904 8.18227 6.38294 11.5748 10.5796 numMergedOcc 0
32 mol 192 unq 0 iso 0 dist 9.67207 9.05666 15.8138 8.15486 14.6227 5.71262 4.64973 6.2016 13.125 11.3924 numMergedOcc 0
33 mol 192 unq 1 iso 0 dist 9.67207 9.05666 15.8138 8.15486 14.6227 5.71262 6.57816 8.3453 12.5081 13.7334 numMergedOcc 0
34 mol 276 unq 0 iso 0 dist 8.0652 7.11272 11.0506 7.3327 14.3341 6.4102 6.40983 7.60807 11.5159 13.3082 numMergedOcc 0
35 mol 276 unq 1 iso 0 dist 8.0652 6.24808 5.88008 7.3327 14.3341 10.2953 6.40983 7.60807 10.1908 13.3082 numMergedOcc 0
36 mol 283 unq 0 iso 0 dist 6.89455 7.92491 6.41403 6.87568 4.90822 6.86733 9.33643 9.28067 14.8501 10.4968 numMergedOcc 0
37 mol 283 unq 1 iso 0 dist 8.821 7.92491 4.69801 6.87568 10.7319 6.86733 12.3485 9.243 12.4981 17.2328 numMergedOcc 0
38 mol 283 unq 2 iso 0 dist 9.82337 7.92491 13.1972 6.87568 7.05375 6.86733 9.33643 5.71075 14.8501 10.4968 numMergedOcc 0
