0 mol 24 unq 0 iso 0 dist 8.10063 8.12171 10.5906 6.77987 6.75063 9.39212 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 5.5483 9.9451 8.38405 7.86479 6.74098 11.8894 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 8.17492 7.77386 7.8821 9.6401 5.74753 6.23298 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.72237 8.04111 5.25902 9.77648 9.81292 11.1059 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.78105 6.9297 5.37898 8.52697 7.19348 3.99035 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 7.78105 6.9297 5.37898 9.66612 5.25684 5.45824 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 6.27877 5.99046 5.25569 6.24296 8.08787 11.0952 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 6.27877 5.99046 5.25569 6.83218 10.4844 12.5181 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 8.01351 4.86532 12.671 6.64714 5.09341 10.6223 numMergedOcc 0
9 mol 91 unq 1 iso 0 dist 8.98201 4.86532 6.11478 6.64714 12.2247 10.6223 numMergedOcc 0
10 mol 91 unq 2 iso 0 dist 6.4026 4.86532 6.42704 6.64714 7.1967 10.6223 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.00416 6.45174 6.08127 5.93561 4.57343 7.14708 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 8.00416 6.45174 6.08127 5.33967 11.3914 9.91505 numMergedOcc 0
13 mol 109 unq 2 iso 0 dist 8.00416 8.46446 15.2262 5.93561 4.57343 13.0165 numMergedOcc 0
14 mol 109 unq 3 iso 0 dist 8.00416 8.46446 15.2262 5.33967 11.3914 7.60413 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.13344 9.68996 17.5356 7.33743 15.4631 4.10674 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 8.11014 9.13228 8.78943 8.90926 13.9278 13.4105 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.70632 5.62193 11.7682 9.1946 13.6274 6.47745 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 7.86721 6.35591 5.39579 8.88095 6.83947 3.80663 numMergedOcc 0
