0 mol 6 unq 0 iso 0 dist 8.07981 8.78583 10.6551 9.27862 3.41098 13.2268 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 8.07981 8.78583 10.6551 6.17194 6.07832 13.4031 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.20647 7.12852 9.73258 7.65918 4.10415 9.41744 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 5.83051 7.12852 6.46914 7.65918 3.21805 9.41744 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.32868 9.62702 4.47011 4.96173 11.6652 12.8632 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 7.32868 6.97484 11.9916 4.96173 11.6652 3.93337 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 6.82522 6.47401 4.41983 6.54247 4.56119 5.65411 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.47476 9.55297 5.65619 5.96324 12.4943 15.1065 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 8.47476 9.55297 5.65619 9.22913 6 11.3121 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 8.47476 7.447 14.1869 5.96324 12.4943 4.49572 numMergedOcc 0
10 mol 141 unq 3 iso 0 dist 8.47476 7.447 14.1869 9.22913 6 12.1401 numMergedOcc 0
11 mol 141 unq 4 iso 0 dist 8.47476 6.59782 8.66026 5.96324 12.4943 6.00277 numMergedOcc 0
12 mol 141 unq 5 iso 0 dist 8.47476 6.59782 8.66026 9.22913 6 5.31466 numMergedOcc 0
13 mol 141 unq 6 iso 0 dist 6.74947 9.55297 15.8344 5.96324 5.51254 15.1065 numMergedOcc 0
14 mol 141 unq 7 iso 0 dist 6.74947 9.55297 15.8344 9.22913 14.501 11.3121 numMergedOcc 0
15 mol 141 unq 8 iso 0 dist 6.74947 7.447 5.25586 5.96324 5.51254 4.49572 numMergedOcc 0
16 mol 141 unq 9 iso 0 dist 6.74947 7.447 5.25586 9.22913 14.501 12.1401 numMergedOcc 0
17 mol 141 unq 10 iso 0 dist 6.74947 6.59782 10.1908 5.96324 5.51254 6.00277 numMergedOcc 0
18 mol 141 unq 11 iso 0 dist 6.74947 6.59782 10.1908 9.22913 14.501 5.31466 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 9.33055 8.15115 13.0385 numMergedOcc 0
20 mol 226 unq 0 iso 0 dist 6.67272 9.51038 4.91346 7.00922 3.56022 7.51349 numMergedOcc 0
21 mol 226 unq 1 iso 0 dist 9.45332 9.51038 11.4807 7.00922 4.56116 7.51349 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 6.91126 6.43838 5.85485 8.28824 3.76405 9.32678 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 6.91126 9.24964 14.9183 8.28824 3.76405 14.2299 numMergedOcc 0
24 mol 235 unq 2 iso 0 dist 9.48967 6.43838 15.6099 8.28824 12.0808 9.32678 numMergedOcc 0
25 mol 235 unq 3 iso 0 dist 9.48967 9.24964 4.28284 8.28824 12.0808 14.2299 numMergedOcc 0
26 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 5.76741 6.64096 4.40718 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 5.33881 9.04755 7.66564 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 6.58667 9.28545 13.5948 7.05489 6.48624 9.13838 numMergedOcc 0
29 mol 277 unq 1 iso 0 dist 6.01542 9.28545 4.29127 7.05489 6.22898 9.13838 numMergedOcc 0
