0 mol 6 unq 0 iso 0 dist 9.68907 7.74208 12.0033 7.46244 12.5999 4.26359 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.2056 5.03976 4.49033 8.35401 9.7591 6.44368 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.68381 7.13638 10.3974 8.26586 7.4999 4.39445 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 8.68381 7.13638 10.3974 9.76234 4.99692 10.7557 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.72287 8.73104 4.4449 8.12626 9.15052 6.16918 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 9.72287 9.31622 10.2051 8.12626 9.15052 8.14214 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.04935 7.93317 9.59811 8.52697 10.0025 13.5391 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 9.04935 7.93317 9.59811 9.66612 10.8249 12.6233 numMergedOcc 0
8 mol 79 unq 2 iso 0 dist 9.04935 7.11013 11.9573 8.52697 10.0025 4.1859 numMergedOcc 0
9 mol 79 unq 3 iso 0 dist 9.04935 7.11013 11.9573 9.66612 10.8249 6.90535 numMergedOcc 0
10 mol 79 unq 4 iso 0 dist 9.04935 9.62096 13.9374 8.52697 10.0025 17.0218 numMergedOcc 0
11 mol 79 unq 5 iso 0 dist 9.04935 9.62096 13.9374 9.66612 10.8249 16.4359 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 9.66549 7.46478 16.1058 6.24296 13.0679 7.2898 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 9.66549 7.46478 16.1058 6.83218 15.4283 4.13305 numMergedOcc 0
14 mol 93 unq 0 iso 0 dist 8.84466 5.77804 12.5605 9.43355 3.91263 12.1673 numMergedOcc 0
15 mol 93 unq 1 iso 0 dist 8.84466 5.77804 12.5605 5.64141 5.59024 7.30779 numMergedOcc 0
16 mol 93 unq 2 iso 0 dist 8.84466 5.77804 12.5605 5.46186 12.9872 9.18194 numMergedOcc 0
17 mol 93 unq 3 iso 0 dist 9.2948 5.77804 10.878 9.43355 15.8131 12.1673 numMergedOcc 0
18 mol 93 unq 4 iso 0 dist 9.2948 5.77804 10.878 5.64141 13.6266 7.30779 numMergedOcc 0
19 mol 93 unq 5 iso 0 dist 9.2948 5.77804 10.878 5.46186 5.17052 9.18194 numMergedOcc 0
20 mol 115 unq 0 iso 0 dist 8.21127 9.36283 12.8154 6.17349 5.33827 9.00091 numMergedOcc 0
21 mol 115 unq 1 iso 0 dist 8.21127 9.36283 12.8154 9.21978 12.6105 6.04071 numMergedOcc 0
22 mol 146 unq 0 iso 0 dist 5.3184 6.66451 10.2064 6.76896 10.5314 4.23789 numMergedOcc 0
23 mol 147 unq 0 iso 0 dist 5.70772 7.9061 4.10092 8.73613 11.5768 11.4653 numMergedOcc 0
24 mol 147 unq 1 iso 0 dist 5.70772 4.48898 4.47436 8.73613 11.5768 7.68412 numMergedOcc 0
25 mol 147 unq 2 iso 0 dist 8.93916 7.6489 4.10092 8.10157 16.3583 13.6845 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 8.94464 7.82604 6.39513 9.19831 7.88733 5.08641 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 8.94464 8.22583 6.24616 9.19831 7.88733 10.9122 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 8.63713 7.82604 5.70246 9.19831 5.76612 5.08641 numMergedOcc 0
29 mol 181 unq 3 iso 0 dist 8.63713 8.22583 14.1913 9.19831 5.76612 10.9122 numMergedOcc 0
30 mol 181 unq 4 iso 0 dist 8.92685 6.62037 5.56759 7.83476 5.31548 4.48306 numMergedOcc 0
31 mol 181 unq 5 iso 0 dist 8.92685 6.21461 4.43465 7.83476 5.31548 4.88823 numMergedOcc 0
32 mol 233 unq 0 iso 0 dist 7.24533 7.40764 5.3674 9.79864 3.98113 6.80416 numMergedOcc 0
33 mol 266 unq 0 iso 0 dist 6.86805 6.41474 10.0609 9.1946 8.9784 5.26429 numMergedOcc 0
34 mol 266 unq 1 iso 0 dist 9.10275 7.98461 12.7711 7.81168 14.4384 9.46948 numMergedOcc 0
35 mol 266 unq 2 iso 0 dist 9.10275 5.60932 10.5909 7.81168 14.4384 4.41057 numMergedOcc 0
36 mol 266 unq 3 iso 0 dist 6.13722 7.98461 9.5105 7.81168 12.9641 9.46948 numMergedOcc 0
37 mol 266 unq 4 iso 0 dist 6.13722 5.60932 9.20087 7.81168 12.9641 4.41057 numMergedOcc 0
