0 mol 10 unq 0 iso 0 dist 7.21183 7.66861 7.5169 4.87139 8.40467 9.2687 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 8.54108 9.50033 8.53135 3.97609 8.58191 5.97852 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 5.68877 5.70643 4.50643 8.73415 5.55479 3.92518 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 8.35366 7.794 8.47518 8.76163 5.87258 4.6365 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 8.69829 9.3469 8.47518 8.72795 5.87258 4.6365 numMergedOcc 0
5 mol 44 unq 2 iso 0 dist 6.30541 4.68435 6.11574 8.35647 9.1276 9.9674 numMergedOcc 0
6 mol 44 unq 3 iso 0 dist 6.14602 4.0144 6.11574 6.99174 9.1276 9.9674 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 5.76869 3.98752 8.32948 5.91159 6.03151 6.28248 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 5.76869 7.08886 7.43338 5.91159 6.03151 3.66253 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 7.36255 5.56848 9.94735 7.3395 5.62688 8.68463 numMergedOcc 0
10 mol 56 unq 1 iso 0 dist 7.36255 4.20743 9.44388 7.3395 5.62688 10.5328 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 9.66828 7.7205 7.26325 4.45029 8.46972 9.14454 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 6.59749 8.04261 4.62366 7.4198 6.91511 4.65363 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.80942 4.90139 8.3622 5.68679 8.14405 10.5172 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.32658 11.9416 7.08934 3.72135 8.0852 8.69327 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 9.32658 11.9416 7.08934 7.66483 8.83222 6.65154 numMergedOcc 0
16 mol 162 unq 2 iso 0 dist 9.32658 10.5412 8.87346 3.72135 8.0852 7.61345 numMergedOcc 0
17 mol 162 unq 3 iso 0 dist 9.32658 10.5412 8.87346 7.66483 8.83222 3.21382 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 9.75562 5.88863 4.59484 8.2542 8.09699 5.35456 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.52954 4.11428 7.30003 4.46929 6.50932 3.89748 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.83646 5.64173 7.75366 3.72761 5.41453 4.70535 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 7.61364 4.53143 8.40277 5.06184 9.42898 4.45525 numMergedOcc 0
22 mol 240 unq 1 iso 0 dist 7.61364 4.53143 8.40277 6.19079 5.53403 9.62569 numMergedOcc 0
23 mol 240 unq 2 iso 0 dist 7.61364 3.96088 6.50985 5.06184 9.42898 8.76686 numMergedOcc 0
24 mol 240 unq 3 iso 0 dist 7.61364 3.96088 6.50985 6.19079 5.53403 5.34658 numMergedOcc 0
25 mol 247 unq 0 iso 0 dist 7.85081 8.17977 8.64941 7.1875 5.52484 3.42642 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 6.43775 4.39302 7.27155 3.63202 7.05095 4.77242 numMergedOcc 0
27 mol 273 unq 0 iso 0 dist 9.83374 5.87385 7.84151 13.0429 8.28809 8.8839 numMergedOcc 0
28 mol 273 unq 1 iso 0 dist 9.83374 14.3152 7.85797 13.0429 8.28809 7.90253 numMergedOcc 0
29 mol 273 unq 2 iso 0 dist 5.75335 3.92089 7.84151 5.19474 8.28809 8.8839 numMergedOcc 0
30 mol 273 unq 3 iso 0 dist 5.75335 9.51983 7.85797 5.19474 8.28809 7.90253 numMergedOcc 0
31 mol 276 unq 0 iso 0 dist 9.51947 5.20175 5.54217 9.32378 9.53331 5.97699 numMergedOcc 0
32 mol 276 unq 1 iso 0 dist 8.9021 4.13451 5.54217 5.54089 9.53331 5.97699 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 7.35799 12.7379 8.51994 6.32559 5.41277 7.98069 numMergedOcc 0
34 mol 280 unq 0 iso 0 dist 4.26671 4.65268 6.38295 5.55901 6.16546 4.06908 numMergedOcc 0
35 mol 283 unq 0 iso 0 dist 9.69083 6.50939 6.53354 12.9436 8.39635 7.87842 numMergedOcc 0
36 mol 283 unq 1 iso 0 dist 9.69083 14.2956 6.93798 12.9436 8.39635 5.55396 numMergedOcc 0
37 mol 283 unq 2 iso 0 dist 5.96202 4.89148 6.53354 3.77125 8.39635 7.87842 numMergedOcc 0
38 mol 283 unq 3 iso 0 dist 5.96202 4.01355 6.93798 3.77125 8.39635 5.55396 numMergedOcc 0
39 mol 283 unq 4 iso 0 dist 9.55068 5.57192 6.53354 11.2772 8.39635 7.87842 numMergedOcc 0
40 mol 283 unq 5 iso 0 dist 9.55068 9.29592 6.93798 11.2772 8.39635 5.55396 numMergedOcc 0
