0 mol 44 unq 0 iso 0 dist 7.40218 4.48566 8.47518 9.88278 6.3575 9.17447 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 4.22514 4.11549 6.29755 11.0479 9.11627 9.70196 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 4.22514 8.12687 7.4038 11.0479 9.11627 9.25341 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 9.0081 7.96488 7.77128 12.0039 5.78327 9.2228 numMergedOcc 0
4 mol 99 unq 0 iso 0 dist 8.6659 6.04335 4.82346 7.28774 5.36117 5.61946 numMergedOcc 0
5 mol 99 unq 1 iso 0 dist 8.4731 6.04335 8.07233 7.28774 7.21001 5.61946 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 5.37345 10.1051 8.88401 16.2707 13.9402 8.75165 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.50959 4.66619 6.21554 8.87505 5.76927 5.74058 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.55581 6.14253 5.92836 5.59311 6.70307 9.56319 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 7.55581 6.14253 5.92836 5.7232 12.974 9.73038 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 7.55581 4.88407 4.73804 14.1379 10.8724 9.48694 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 7.55581 4.88407 4.73804 5.59311 6.70307 6.65267 numMergedOcc 0
12 mol 172 unq 0 iso 0 dist 9.40213 9.70426 4.90175 16.8241 8.74106 8.03804 numMergedOcc 0
13 mol 172 unq 1 iso 0 dist 8.75042 12.33 4.90175 15.7071 8.74106 8.03804 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 5.15834 6.2739 8.44321 7.76856 11.8927 6.60418 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 9.25573 4.25603 7.98724 11.4172 9.60101 8.09185 numMergedOcc 0
16 mol 212 unq 1 iso 0 dist 9.25573 4.25603 7.98724 10.2812 14.4351 7.27225 numMergedOcc 0
17 mol 212 unq 2 iso 0 dist 9.25573 4.25603 7.98724 12.352 11.1018 8.14212 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.37114 8.84473 5.17916 12.3791 6.45821 4.87053 numMergedOcc 0
19 mol 241 unq 0 iso 0 dist 4.66398 10.4606 8.00841 10.2106 6.26153 9.55645 numMergedOcc 0
20 mol 241 unq 1 iso 0 dist 9.05448 5.2107 8.00841 10.3467 6.26153 9.55645 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 7.11407 11.4035 6.93798 13.4669 7.50871 5.90728 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.85872 9.44841 7.58907 14.9875 9.43796 9.38187 numMergedOcc 0
23 mol 287 unq 1 iso 0 dist 8.72085 5.05806 9.84741 7.90634 10.5636 7.3388 numMergedOcc 0
24 mol 287 unq 2 iso 0 dist 8.01428 14.4188 9.30394 16.0484 10.5258 6.19545 numMergedOcc 0
25 mol 287 unq 3 iso 0 dist 8.01428 10.5276 8.5458 16.0484 10.5258 6.96248 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.85872 9.44841 7.58907 14.9875 9.43796 9.38187 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 8.72085 5.05806 9.84741 7.90634 10.5636 7.3388 numMergedOcc 0
28 mol 288 unq 2 iso 0 dist 8.01428 14.4188 9.30394 16.0484 10.5258 6.19545 numMergedOcc 0
29 mol 288 unq 3 iso 0 dist 8.01428 10.5276 8.5458 16.0484 10.5258 6.96248 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 8.85872 9.44841 7.58907 14.9875 9.43796 9.38187 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 8.72085 5.05806 9.84741 7.90634 10.5636 7.3388 numMergedOcc 0
32 mol 289 unq 2 iso 0 dist 8.01428 14.4188 9.30394 16.0484 10.5258 6.19545 numMergedOcc 0
33 mol 289 unq 3 iso 0 dist 8.01428 10.5276 8.5458 16.0484 10.5258 6.96248 numMergedOcc 0
