0 mol 5 unq 0 iso 0 dist 7.77631 5.44356 3.14155 8.39424 7.56229 5.69239 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.13078 7.18124 11.1587 7.19357 7.7447 8.25818 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.13078 6.47026 8.72577 7.19357 7.7447 10.2171 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.26667 9.13786 3.08756 3.30907 8.67216 9.63882 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 9.26667 8.56807 3.30447 3.30907 8.67216 6.87277 numMergedOcc 0
5 mol 30 unq 2 iso 0 dist 9.99577 8.28218 3.08756 9.23676 8.67216 9.63882 numMergedOcc 0
6 mol 30 unq 3 iso 0 dist 9.99577 8.10811 14.5119 9.23676 8.67216 17.0544 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 6.8848 7.73753 4.73277 5.98039 8.78414 8.14512 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 6.33905 8.32093 7.18877 10.6352 5.64092 12.4458 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 6.33905 8.32093 7.18877 5.29172 8.71074 7.7485 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 7.52245 6.48394 5.36604 15.3817 8.39955 13.2603 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 5.51954 9.77068 10.7138 10.8704 9.54696 16.4382 numMergedOcc 0
12 mol 79 unq 1 iso 0 dist 5.51954 9.77068 10.7138 3.26501 4.62636 10.7343 numMergedOcc 0
13 mol 95 unq 0 iso 0 dist 9.55761 9.36638 11.2836 5.08555 9.50709 10.9714 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 6.03035 8.46167 9.59189 4.62493 8.67025 5.31126 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 6.03035 6.13175 10.1118 4.62493 8.67025 4.49669 numMergedOcc 0
16 mol 113 unq 2 iso 0 dist 6.03035 4.34107 8.19901 4.62493 8.67025 6.00221 numMergedOcc 0
17 mol 116 unq 0 iso 0 dist 9.02925 7.39112 3.43966 4.89202 7.54274 6.55227 numMergedOcc 0
18 mol 157 unq 0 iso 0 dist 8.61764 9.27485 11.4303 10.3822 7.91458 16.7079 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 4.56607 8.04472 8.57798 5.441 7.25623 13.131 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 4.56607 5.62851 3.74437 5.441 7.25623 8.53111 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 9.61582 9.64977 3.60793 13.3603 8.17928 7.25595 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 9.43831 8.07881 11.4758 5.14008 5.6417 11.0394 numMergedOcc 0
23 mol 254 unq 1 iso 0 dist 9.43831 5.44351 8.8967 5.14008 5.6417 7.85841 numMergedOcc 0
24 mol 254 unq 2 iso 0 dist 9.43831 6.34051 10.929 5.14008 5.6417 9.20109 numMergedOcc 0
25 mol 286 unq 0 iso 0 dist 9.2551 6.87255 5.83399 13.5954 8.75926 12.7554 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 9.62446 8.70479 11.4704 3.39991 8.06767 10.9435 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 9.99681 8.70479 16.9251 3.39991 9.91087 10.9435 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.62446 8.70479 11.4704 3.39991 8.06767 10.9435 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 9.99681 8.70479 16.9251 3.39991 9.91087 10.9435 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 9.62446 8.70479 11.4704 3.39991 8.06767 10.9435 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 9.99681 8.70479 16.9251 3.39991 9.91087 10.9435 numMergedOcc 0
