0 mol 90 unq 0 iso 0 dist 7.63894 8.43244 7.54496 9.64845 7.31784 4.48233 14.3504 9.08732 9.67572 5.97902 numMergedOcc 0
1 mol 90 unq 1 iso 0 dist 6.17315 12.4268 7.54496 12.0042 7.31784 4.48233 13.8307 9.08732 9.67572 5.97902 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 7.46327 4.55399 7.85041 10.4036 7.62611 6.957 13.113 6.46217 11.5028 6.4154 numMergedOcc 0
3 mol 147 unq 0 iso 0 dist 9.60646 12.0852 5.1101 10.23 7.25644 10.7872 9.43694 7.19893 7.97454 13.5462 numMergedOcc 0
4 mol 147 unq 1 iso 0 dist 9.60646 12.0852 5.1101 10.23 7.25644 10.7872 12.442 6.37938 3.547 13.2259 numMergedOcc 0
5 mol 147 unq 2 iso 0 dist 9.60646 14.0758 7.01133 10.23 7.25644 7.66774 9.43694 7.19893 13.3536 13.5462 numMergedOcc 0
6 mol 147 unq 3 iso 0 dist 9.60646 14.0758 7.01133 10.23 7.25644 7.66774 12.442 6.37938 9.88741 13.2259 numMergedOcc 0
7 mol 151 unq 0 iso 0 dist 8.14552 4.96324 5.63814 7.93506 4.74531 8.3622 7.44732 9.06016 4.26123 11.8889 numMergedOcc 0
8 mol 151 unq 1 iso 0 dist 6.01918 8.48544 5.63814 4.27432 4.74531 8.3622 12.6611 9.06016 4.26123 11.8889 numMergedOcc 0
9 mol 163 unq 0 iso 0 dist 9.07256 12.2445 8.21476 4.59718 9.79069 15.4471 5.6495 7.69757 11.6682 6.5925 numMergedOcc 0
10 mol 163 unq 1 iso 0 dist 9.07256 12.2445 8.21476 13.6675 9.27496 9.33755 5.6495 7.69757 11.6682 15.5126 numMergedOcc 0
11 mol 163 unq 2 iso 0 dist 9.07256 5.48417 7.66897 4.59718 9.79069 9.54216 5.6495 7.69757 7.1982 6.5925 numMergedOcc 0
12 mol 163 unq 3 iso 0 dist 9.07256 5.48417 7.66897 13.6675 9.27496 10.7572 5.6495 7.69757 7.1982 15.5126 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 6.78113 9.50216 8.89822 9.66017 8.2169 11.9845 7.7167 8.62437 15.2041 7.36876 numMergedOcc 0
14 mol 182 unq 1 iso 0 dist 6.78113 9.50216 8.89822 9.66017 8.2169 11.9845 5.91263 7.07405 9.61248 4.17332 numMergedOcc 0
15 mol 182 unq 2 iso 0 dist 6.78113 9.50216 8.89822 5.91922 8.52103 12.8718 7.7167 8.62437 15.2041 3.73864 numMergedOcc 0
16 mol 182 unq 3 iso 0 dist 6.78113 9.50216 8.89822 5.91922 8.52103 12.8718 5.91263 7.07405 9.61248 3.85553 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 6.98756 7.28957 7.37935 6.26806 8.42053 9.84448 4.00981 7.79105 10.4239 4.40538 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 7.84953 10.2089 6.86795 5.95332 8.3087 5.89482 13.0752 8.98941 4.24855 8.98584 numMergedOcc 0
19 mol 218 unq 1 iso 0 dist 7.84953 10.2089 6.86795 5.95332 8.3087 5.89482 6.43551 6.45381 5.31276 3.90135 numMergedOcc 0
20 mol 218 unq 2 iso 0 dist 7.84953 4.40481 6.61099 5.95332 8.3087 6.65167 13.0752 8.98941 10.7049 8.98584 numMergedOcc 0
21 mol 218 unq 3 iso 0 dist 7.84953 4.40481 6.61099 5.95332 8.3087 6.65167 6.43551 6.45381 4.36581 3.90135 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.70241 10.4764 7.25677 7.74918 7.85414 6.56697 15.8835 8.78893 6.50127 12.1127 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 8.64036 10.945 9.96468 10.9909 8.53065 6.18986 14.0896 9.9322 14.9487 9.21292 numMergedOcc 0
24 mol 282 unq 1 iso 0 dist 8.64036 10.945 9.96468 8.39689 8.67489 9.09482 14.0896 9.9322 14.9487 17.93 numMergedOcc 0
25 mol 282 unq 2 iso 0 dist 8.64036 12.1895 9.59817 10.9909 8.53065 10.2999 14.0896 9.9322 17.4495 9.21292 numMergedOcc 0
26 mol 282 unq 3 iso 0 dist 8.64036 12.1895 9.59817 8.39689 8.67489 6.21176 14.0896 9.9322 17.4495 17.93 numMergedOcc 0
