0 mol 8 unq 0 iso 0 dist 8.79897 8.27706 7.91052 10.9865 7.74386 4.04843 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.04621 7.88348 7.43758 10.4653 8.24422 4.24515 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 9.04621 7.88348 7.43758 5.51879 8.99724 5.03315 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.44081 8.72422 7.43758 12.3614 8.24422 4.24515 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 8.44081 8.72422 7.43758 9.5295 8.99724 5.03315 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 6.93878 7.74348 4.09276 7.68244 8.67141 5.47588 numMergedOcc 0
6 mol 32 unq 1 iso 0 dist 5.73722 5.78755 7.65602 14.2927 9.46895 12.428 numMergedOcc 0
7 mol 44 unq 0 iso 0 dist 9.06073 12.3312 8.35366 5.4204 8.47518 7.794 numMergedOcc 0
8 mol 44 unq 1 iso 0 dist 9.06073 12.9794 8.69829 5.4204 8.47518 9.3469 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 7.36132 5.92597 9.91313 8.24666 7.77128 12.5852 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 8.66329 15.4781 8.18252 6.16672 9.20236 17.3577 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 8.66329 14.6051 7.55531 6.16672 9.20236 15.2873 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 7.4348 12.3845 9.79739 13.5908 8.88401 4.45483 numMergedOcc 0
13 mol 151 unq 0 iso 0 dist 8.7814 15.303 9.39452 7.259 7.93343 15.0568 numMergedOcc 0
14 mol 151 unq 1 iso 0 dist 8.7814 15.303 9.39452 4.43408 5.89468 14.3657 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 7.16289 4.81196 6.59749 6.40531 4.62366 8.04261 numMergedOcc 0
16 mol 154 unq 1 iso 0 dist 9.3164 7.0408 6.59749 13.1055 4.62366 8.04261 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 8.63202 11.452 9.75562 6.94063 4.59484 5.88863 numMergedOcc 0
18 mol 171 unq 1 iso 0 dist 4.46397 8.85582 9.75562 4.53761 4.59484 5.88863 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 8.1177 11.1998 7.43427 9.44187 9.11823 4.32641 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 8.1177 3.82019 7.50841 9.44187 9.11823 5.84356 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 9.73405 7.06858 5.83646 12.7026 7.75366 5.64173 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 7.26496 8.30331 7.61364 11.2383 8.40277 4.53143 numMergedOcc 0
23 mol 240 unq 1 iso 0 dist 7.26496 8.30331 7.61364 8.7212 6.50985 3.96088 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 8.43923 8.76762 8.66164 4.81019 9.04888 12.4291 numMergedOcc 0
25 mol 271 unq 0 iso 0 dist 7.88092 3.76546 8.54162 6.04262 5.76281 5.60228 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 9.94974 16.1108 7.35799 10.4755 8.51994 12.7379 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 4.54596 3.82462 7.35799 9.899 8.51994 12.7379 numMergedOcc 0
28 mol 279 unq 2 iso 0 dist 8.32942 6.05145 7.35799 12.7813 8.51994 12.7379 numMergedOcc 0
