0 mol 1 unq 0 iso 0 dist 9.62879 8.72514 5.61792 6.28298 8.21384 10.7586 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.10175 8.41365 10.352 5.01159 5.7405 6.30987 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 4.87423 8.05492 8.13095 5.86791 9.03987 12.0199 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 4.76283 9.27619 8.13095 9.2661 9.03987 12.0199 numMergedOcc 0
4 mol 71 unq 2 iso 0 dist 7.75237 8.05492 5.63957 5.86791 8.63476 12.0199 numMergedOcc 0
5 mol 71 unq 3 iso 0 dist 7.86678 6.88394 6.56561 12.8239 8.44181 13.9005 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 4.85152 7.36397 6.12826 5.47738 7.2131 10.8245 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 4.85152 7.36397 6.12826 4.665 7.44343 6.72712 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 4.85152 6.58062 5.02124 5.47738 7.2131 7.1539 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 4.85152 6.58062 5.02124 4.665 7.44343 5.39745 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.26291 6.16039 12.2551 9.33864 5.05277 14.3363 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 7.8034 6.66749 5.53162 11.5898 9.39811 14.1191 numMergedOcc 0
12 mol 135 unq 0 iso 0 dist 7.54797 7.38478 5.50426 10.6553 9.03598 10.5009 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.98097 8.12409 9.3538 10.537 9.80549 14.9679 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 6.67598 9.40225 10.3893 5.02458 9.6281 5.81122 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 8.79185 9.40225 7.02779 5.02458 6.22667 5.81122 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 5.13722 7.95111 11.1645 4.84884 5.0207 12.1114 numMergedOcc 0
17 mol 193 unq 0 iso 0 dist 9.16852 9.42057 14.5828 5.35985 9.82224 10.2835 numMergedOcc 0
18 mol 193 unq 1 iso 0 dist 9.16852 9.42057 14.5828 12.1335 8.95886 14.1586 numMergedOcc 0
19 mol 193 unq 2 iso 0 dist 5.19654 8.52642 10.9221 12.9817 9.82224 19.6219 numMergedOcc 0
20 mol 193 unq 3 iso 0 dist 5.19654 8.52642 10.9221 10.7013 8.95886 14.168 numMergedOcc 0
21 mol 219 unq 0 iso 0 dist 7.98941 9.69976 10.277 14.1483 9.30312 16.0398 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 9.92947 6.04427 12.7034 6.64902 9.42667 12.6285 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 7.46044 6.04427 7.89905 4.07416 6.48885 8.64644 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 4.46314 8.94854 10.5464 10.7624 6.67239 15.5694 numMergedOcc 0
25 mol 232 unq 1 iso 0 dist 4.46314 8.94854 10.5464 8.15893 6.23146 12.9353 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 8.78008 9.10967 5.28695 5.41296 5.4347 7.02079 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 8.38727 8.84139 5.36282 4.32336 8.02757 7.7574 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 6.6731 9.418 5.84058 4.34105 8.02757 8.92185 numMergedOcc 0
29 mol 259 unq 2 iso 0 dist 6.6731 9.26725 5.36282 4.34105 8.02757 7.7574 numMergedOcc 0
30 mol 259 unq 3 iso 0 dist 9.83696 8.10823 5.84058 11.2938 8.02757 8.92185 numMergedOcc 0
31 mol 277 unq 0 iso 0 dist 9.42812 8.62043 8.46112 13.008 5.92532 13.3793 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 8.76889 6.10834 7.28266 4.99186 8.16582 9.24367 numMergedOcc 0
33 mol 279 unq 1 iso 0 dist 7.04397 8.24233 7.28266 8.17282 8.16582 9.24367 numMergedOcc 0
