0 mol 79 unq 0 iso 0 dist 7.78105 6.9297 5.37898 4.82573 8.61089 5.33546 numMergedOcc 0
1 mol 91 unq 0 iso 0 dist 8.01351 4.86532 12.671 4.4056 8.91354 7.12701 numMergedOcc 0
2 mol 91 unq 1 iso 0 dist 8.98201 4.86532 6.11478 4.4056 12.3528 7.12701 numMergedOcc 0
3 mol 91 unq 2 iso 0 dist 6.4026 4.86532 6.42704 4.4056 10.7542 7.12701 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 6.67776 7.63783 8.71469 8.23165 13.9538 9.52206 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 6.67776 7.63783 8.71469 15.1013 17.3979 8.69945 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 9.83243 5.65876 9.67391 12.7823 14.9397 7.7461 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 9.83243 9.13825 5.68124 12.7823 14.9397 9.53985 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.89564 8.9967 10.0563 7.57026 14.6915 8.809 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 8.6903 8.94488 7.46548 4.0331 9.38856 6.69487 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 8.43359 7.57117 8.7874 11.1214 10.4355 8.14859 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 8.43359 9.9312 7.84006 11.1214 10.4355 5.62421 numMergedOcc 0
12 mol 193 unq 0 iso 0 dist 8.30095 6.77983 11.8686 3.79373 11.0513 9.16058 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 8.5734 9.3437 8.18632 6.01671 5.61326 9.854 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 9.79447 8.72409 4.65019 6.60289 6.28935 8.70049 numMergedOcc 0
15 mol 229 unq 1 iso 0 dist 9.79447 8.72409 4.65019 7.70905 8.4208 9.55385 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 9.19506 6.7282 11.2425 4.34115 8.00386 9.58168 numMergedOcc 0
17 mol 255 unq 0 iso 0 dist 5.84157 8.33795 6.1967 4.52659 7.57779 8.88059 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 7.86721 6.35591 5.39579 9.21946 13.1653 8.07169 numMergedOcc 0
