0 mol 79 unq 0 iso 0 dist 5.55798 7.06029 4.13187 6.05149 8.64686 6.65972 8.71103 9.57704 8.14479 7.41952 numMergedOcc 0
1 mol 129 unq 0 iso 0 dist 6.65878 7.84813 6.61102 5.0466 7.6453 4.4077 8.63018 5.06265 6.14663 7.07421 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 6.9268 4.82356 4.63862 8.75242 5.79195 9.35049 6.85651 5.35551 3.75786 9.07294 numMergedOcc 0
3 mol 133 unq 1 iso 0 dist 8.19166 8.83476 4.63862 6.45333 5.79195 9.35049 7.03858 5.35551 3.75786 9.07294 numMergedOcc 0
4 mol 210 unq 0 iso 0 dist 5.70065 9.49242 5.81094 13.3519 10.3236 7.95917 9.97171 5.02037 5.30972 6.41444 numMergedOcc 0
5 mol 230 unq 0 iso 0 dist 5.19913 6.99256 3.86973 6.28086 9.24729 8.01593 11.236 11.0843 7.62813 6.88683 numMergedOcc 0
6 mol 258 unq 0 iso 0 dist 5.9223 6.61322 5.05766 9.26732 8.58092 5.94328 10.3095 13.2474 8.9947 8.97411 numMergedOcc 0
7 mol 266 unq 0 iso 0 dist 9.80006 7.93375 3.94797 5.54798 10.0796 6.48382 11.7492 19.729 16.2409 9.77392 numMergedOcc 0
8 mol 280 unq 0 iso 0 dist 6.16854 9.22665 6.10543 9.13465 10.6331 7.00616 7.10723 5.40352 3.76721 7.02503 numMergedOcc 0
9 mol 280 unq 1 iso 0 dist 6.16854 9.22665 6.10543 14.2183 14.3004 9.19653 7.10723 5.40352 3.76721 9.18164 numMergedOcc 0
10 mol 285 unq 0 iso 0 dist 7.38536 5.28731 3.57803 9.97666 13.2077 9.66678 17.2934 20.0329 16.8309 8.63954 numMergedOcc 0
11 mol 285 unq 1 iso 0 dist 7.38536 5.28731 3.57803 9.97666 13.2077 9.66678 12.3495 13.7389 10.6606 4.74716 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 12.4464 15.9418 14.6969 8.0935 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 12.4464 10.4601 14.6969 8.0935 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 12.4464 8.13485 14.6969 8.0935 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 12.4464 15.9418 14.6969 8.0935 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 12.4464 10.4601 14.6969 8.0935 numMergedOcc 0
17 mol 288 unq 2 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 12.4464 8.13485 14.6969 8.0935 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 6.19545 6.16127 4.00861 5.66584 10.9141 9.31611 12.4464 15.9418 14.6969 8.0935 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.3388 6.16127 5.03775 5.66584 6.96774 9.31611 12.4464 10.4601 14.6969 8.0935 numMergedOcc 0
20 mol 289 unq 2 iso 0 dist 6.96248 6.16127 8.95194 5.66584 7.14859 9.31611 12.4464 8.13485 14.6969 8.0935 numMergedOcc 0
