0 mol 10 unq 0 iso 0 dist 5.66059 7.62587 9.43029 8.09253 3.92592 9.39486 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 5.99743 4.75564 6.18431 6.47443 5.83346 7.14537 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 5.99743 4.75564 6.18431 10.7108 4.99208 9.39486 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 9.70029 11.4523 6.13351 11.9824 3.91611 5.27182 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.67118 12.0125 7.98985 14.5578 7.71726 5.7369 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.80375 5.56727 5.7684 12.083 12.3893 8.46627 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.80375 5.56727 5.7684 11.7824 14.6305 9.22208 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 4.73362 6.65453 7.46095 13.3552 10.1364 9.59729 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 7.3795 7.15288 7.46095 8.8326 10.1364 9.59729 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 7.03339 8.58795 9.26353 7.77418 5.08111 7.31064 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.61279 5.78168 5.29898 11.5543 10.1551 7.92216 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 8.24791 9.10646 8.33407 11.5679 4.8427 7.01095 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 5.25309 4.9387 8.06308 12.3619 11.9796 9.92831 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 6.65725 9.35176 7.81263 9.07247 4.67256 4.61596 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 6.65275 9.92572 8.91971 17.1443 15.624 8.85955 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 6.65275 9.92572 8.91971 15.5568 12.8337 6.09335 numMergedOcc 0
16 mol 227 unq 2 iso 0 dist 9.90065 12.598 9.18728 16.2261 8.62578 8.85955 numMergedOcc 0
17 mol 227 unq 3 iso 0 dist 9.90065 12.598 9.18728 17.2532 10.5007 6.09335 numMergedOcc 0
