0 mol 15 unq 0 iso 0 dist 8.0637 4.27439 7.42909 7.38118 5.70754 5.68079 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 4.70023 8.5884 10.1522 5.70763 8.02671 11.8311 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 4.70023 8.5884 10.1522 5.79003 6.09533 12.3965 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 5.9948 8.24316 8.34712 4.3475 8.76224 7.7871 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.64067 8.26423 8.93644 3.82278 8.69574 6.68153 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 6.64067 8.21972 12.1723 3.82278 8.69574 11.0127 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 8.23695 6.57773 13.2028 13.2176 9.00612 17.3605 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 9.0101 7.52544 7.7047 6.27527 6.46582 9.0369 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 9.0101 8.08674 4.00834 6.27527 6.46582 5.91098 numMergedOcc 0
9 mol 76 unq 2 iso 0 dist 9.0101 8.33694 9.6911 6.27527 6.46582 4.86523 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 9.79535 9.75856 5.53481 13.8801 8.56269 11.2961 numMergedOcc 0
11 mol 88 unq 1 iso 0 dist 9.79535 9.75856 5.53481 7.19267 9.40699 5.6516 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 6.31509 9.74889 6.99582 5.90092 9.68556 9.45257 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 8.49806 9.74889 4.34199 5.90092 8.73928 9.45257 numMergedOcc 0
14 mol 99 unq 0 iso 0 dist 5.64099 8.35131 7.49333 4.19068 7.80019 6.65947 numMergedOcc 0
15 mol 103 unq 0 iso 0 dist 8.8763 8.84955 14.6504 7.6171 5.53454 15.0804 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 8.80094 8.66519 16.2482 3.6038 8.47543 10.2021 numMergedOcc 0
17 mol 168 unq 1 iso 0 dist 8.07126 8.35731 16.2482 4.88037 8.47543 10.2021 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 8.65601 5.314 9.74229 12.6752 6.91244 15.0664 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.70166 9.12896 5.55359 8.02399 8.49554 9.92651 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 6.50591 5.62758 6.56312 6.47265 7.45831 11.1663 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.44043 9.27225 9.26732 6.55101 6.61322 5.94328 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.79012 5.16772 13.9264 8.90225 7.88108 13.0633 numMergedOcc 0
23 mol 260 unq 1 iso 0 dist 8.79012 5.16772 13.9264 4.38276 9.46576 6.90472 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 9.477 9.51286 5.54798 4.58167 7.93375 6.48382 numMergedOcc 0
