0 mol 17 unq 0 iso 0 dist 5.41678 8.44037 5.22923 15.7371 12.6265 8.26398 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.57724 9.04157 12.303 13.9547 19.8023 7.94376 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.77613 7.32472 5.29955 7.57532 10.2677 7.37118 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.9175 9.80453 3.42062 6.0363 8.16033 9.42099 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 15.3449 12.1571 9.13593 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 6.24764 8.21116 6.17121 15.3449 12.1571 8.25144 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 8.23533 5.52904 4.66066 7.6026 13.1963 8.61893 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 8.96016 5.61418 6.71463 10.8137 10.1826 7.54574 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.44588 9.27028 3.7042 7.73772 10.085 9.62952 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 6.98104 5.56913 8.97988 4.60771 9.68911 9.82836 numMergedOcc 0
10 mol 117 unq 1 iso 0 dist 6.98104 5.56913 8.97988 6.85703 11.0881 6.5788 numMergedOcc 0
11 mol 117 unq 2 iso 0 dist 6.98104 5.56913 8.97988 9.39186 12.7478 6.2771 numMergedOcc 0
12 mol 117 unq 3 iso 0 dist 8.56221 5.56913 3.65999 4.60771 12.6816 9.82836 numMergedOcc 0
13 mol 117 unq 4 iso 0 dist 8.56221 5.56913 3.65999 6.85703 9.40308 6.5788 numMergedOcc 0
14 mol 117 unq 5 iso 0 dist 8.56221 5.56913 3.65999 9.39186 8.00497 6.2771 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 9.28392 6.18165 13.6106 15.414 21.0835 9.84538 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 5.98732 5.3865 3.89698 5.56847 6.7282 8.76518 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 7.69551 7.13397 7.27279 5.72956 8.75324 6.49413 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 7.69551 5.33278 5.97575 5.72956 8.75324 4.52405 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 9.79394 8.78416 3.86368 13.7467 6.67593 6.18742 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 9.79394 9.22428 7.4282 13.7467 6.67593 6.8089 numMergedOcc 0
21 mol 281 unq 2 iso 0 dist 6.52115 7.82358 3.86368 12.8593 6.67593 6.18742 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.62338 7.96707 3.76412 16.0629 12.182 9.23152 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.62338 7.96707 3.76412 16.0629 12.182 9.23152 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.62338 7.96707 3.76412 16.0629 12.182 9.23152 numMergedOcc 0
