0 mol 0 unq 0 iso 0 dist 6.99594 7.65884 6.3267 9.42137 10.3034 9.23213 7.31837 6.0597 8.34244 5.24778 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.77049 6.67398 7.2199 12.8762 11.4878 8.47421 9.8978 6.0397 9.57198 9.5997 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.95341 9.03359 7.2199 13.0231 11.4878 8.47421 6.26276 6.0397 9.57198 9.5997 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 9.19658 8.05284 8.11206 16.4314 10.1814 9.77484 12.9828 4.73598 8.71752 6.65855 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 9.19658 8.05284 8.11206 16.4314 10.1814 9.77484 7.42669 7.47886 7.60283 14.3929 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.68726 5.85924 6.5096 10.7681 5.3525 6.71911 12.9701 7.0313 9.2902 9.64444 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.58063 10.3316 6.40036 12.5192 10.2377 7.76729 10.2513 5.67953 7.70313 14.0688 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.9344 6.2062 5.99299 10.8427 9.58627 7.92688 11.4454 5.59913 6.51868 5.92062 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 8.9344 6.2062 5.99299 10.8427 9.58627 7.92688 7.31633 6.27692 7.34698 6.61891 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 9.16944 5.10076 6.51096 6.7973 4.9093 7.16254 13.2147 7.6506 9.0529 10.4923 numMergedOcc 0
10 mol 155 unq 1 iso 0 dist 9.16944 5.10076 6.51096 10.6879 6.3437 9.14392 13.2147 7.6506 9.0529 6.89781 numMergedOcc 0
11 mol 155 unq 2 iso 0 dist 8.02593 5.92486 7.37901 15.767 13.5062 9.86313 12.8574 5.50045 9.80845 11.0769 numMergedOcc 0
12 mol 155 unq 3 iso 0 dist 8.02593 5.92486 7.37901 15.767 13.5062 9.86313 10.463 6.40403 7.55196 10.4923 numMergedOcc 0
13 mol 155 unq 4 iso 0 dist 8.02593 5.92486 7.37901 12.6683 8.27726 7.51198 12.8574 5.50045 9.80845 5.50031 numMergedOcc 0
14 mol 155 unq 5 iso 0 dist 8.02593 5.92486 7.37901 12.6683 8.27726 7.51198 10.463 6.40403 7.55196 6.89781 numMergedOcc 0
15 mol 155 unq 6 iso 0 dist 8.77391 9.36845 7.37901 15.1572 13.5062 9.86313 10.9644 5.50045 9.80845 11.0769 numMergedOcc 0
16 mol 155 unq 7 iso 0 dist 8.77391 9.36845 7.37901 15.1572 13.5062 9.86313 13.788 6.40403 7.55196 10.4923 numMergedOcc 0
17 mol 155 unq 8 iso 0 dist 8.77391 9.36845 7.37901 11.1867 8.27726 7.51198 10.9644 5.50045 9.80845 5.50031 numMergedOcc 0
18 mol 155 unq 9 iso 0 dist 8.77391 9.36845 7.37901 11.1867 8.27726 7.51198 13.788 6.40403 7.55196 6.89781 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 8.45395 7.58472 8.20656 14.039 6.80228 9.6668 5.66363 4.43678 5.95304 9.34211 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 9.15368 4.24915 8.20656 12.9138 6.80228 9.6668 5.97968 4.43678 5.95304 9.34211 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 9.20477 5.70246 8.20656 11.7479 6.80228 9.6668 8.63119 4.43678 5.95304 9.34211 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 5.41368 7.58472 9.40622 14.039 11.6919 9.6668 5.66363 6.03415 5.95304 9.34211 numMergedOcc 0
23 mol 181 unq 4 iso 0 dist 7.96182 4.24915 9.40622 12.9138 11.6919 9.6668 5.97968 6.03415 5.95304 9.34211 numMergedOcc 0
24 mol 181 unq 5 iso 0 dist 7.90237 5.70246 9.40622 11.7479 11.6919 9.6668 8.63119 6.03415 5.95304 9.34211 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 9.74324 10.5623 7.27958 14.8362 10.6981 8.21247 12.3837 4.29892 7.95766 7.60081 numMergedOcc 0
26 mol 235 unq 1 iso 0 dist 8.19915 5.85485 7.27958 9.80261 6.43692 5.65339 12.0156 10.1944 6.54825 7.77516 numMergedOcc 0
27 mol 270 unq 0 iso 0 dist 8.76013 6.41275 8.39167 7.82003 10.4895 8.25349 8.55914 5.91256 7.89388 5.43023 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 8.62431 5.95459 8.49866 6.55855 14.168 9.19234 6.83113 11.0599 9.20749 5.64601 numMergedOcc 0
