0 mol 25 unq 0 iso 0 dist 7.685 5.81959 9.96732 7.6114 7.1845 11.4877 10.6808 16.7035 6.90155 16.617 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 6.34173 9.44459 5.94047 9.33906 6.00679 10.7651 5.24762 7.06308 6.06454 11.5679 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.70133 7.04044 11.2505 9.73086 6.15714 7.8972 5.4148 4.65521 8.73253 7.4369 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 4.65521 8.73253 11.2505 8.68662 6.10063 10.9746 5.4148 8.70133 7.04044 12.2276 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 4.65521 8.73253 11.2505 7.4369 6.15714 7.8972 5.4148 8.70133 7.04044 9.73086 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 7.13087 5.16364 5.69513 8.72682 10.1413 5.56296 8.07446 13.6145 8.85586 10.2939 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 7.13087 5.16364 5.69513 6.45841 7.79034 6.69436 8.07446 13.6145 8.85586 8.62198 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 7.13087 5.16364 5.69513 5.61588 8.97361 5.50891 8.07446 13.6145 8.85586 5.5087 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 7.13087 5.16364 5.69513 7.83244 10.2983 4.75954 8.07446 13.6145 8.85586 6.08682 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 5.87358 5.34214 5.94311 7.07971 5.15674 6.8409 4.98336 9.20981 7.55384 11.8087 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.79571 8.20836 9.65798 7.21868 5.67107 4.935 5.62899 13.0121 7.36779 9.66543 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.93652 6.69515 8.00633 8.07097 4.22522 5.25982 6.21253 11.8898 7.86572 11.5913 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 8.36117 7.62942 9.08602 9.03441 9.33403 8.89297 10.7531 9.36654 6.60567 14.2497 numMergedOcc 0
13 mol 195 unq 1 iso 0 dist 6.77578 7.62942 8.18628 9.03441 4.191 8.89297 10.7531 11.955 6.60567 14.2497 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 8.53199 5.76954 8.21424 7.33709 11.6662 6.57708 4.72474 12.0819 6.29367 8.75536 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 8.53199 5.76954 8.21424 7.33709 11.6662 6.57708 5.61978 13.6555 9.20961 6.67404 numMergedOcc 0
16 mol 218 unq 2 iso 0 dist 8.53199 6.29511 10.1198 7.33709 11.6662 13.4147 4.72474 12.0819 8.86175 8.75536 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.62609 5.4694 5.23507 6.91318 11.5454 7.3164 5.22356 13.4493 8.38865 5.23634 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 8.17891 8.38865 5.92529 5.23634 4.09934 7.3164 5.22356 6.95902 5.4694 6.91318 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 6.95902 5.4694 5.92529 6.91318 4.09934 7.3164 5.22356 8.17891 8.38865 5.23634 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 9.5707 7.5366 16.5499 7.81215 11.8229 11.0592 9.82284 17.3705 7.56091 16.672 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 9.5707 7.5366 16.5499 7.81215 11.8229 11.0592 5.88703 10.3388 8.24186 11.6391 numMergedOcc 0
22 mol 234 unq 2 iso 0 dist 7.85175 7.5366 13.0974 7.81215 10.5304 11.0592 9.82284 14.5666 7.56091 16.672 numMergedOcc 0
23 mol 234 unq 3 iso 0 dist 7.85175 7.5366 13.0974 7.81215 10.5304 11.0592 5.88703 6.25105 8.24186 11.6391 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 9.68513 6.4398 6.48619 8.82351 5.99163 6.22195 5.40359 12.5477 6.66971 11.1059 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 9.68513 6.4398 6.48619 8.82351 5.99163 6.22195 10.1648 9.29858 7.32982 12.7605 numMergedOcc 0
26 mol 238 unq 2 iso 0 dist 9.29858 7.32982 6.48619 9.72188 11.7938 13.0611 10.0191 12.5477 6.66971 14.4013 numMergedOcc 0
27 mol 238 unq 3 iso 0 dist 9.29858 7.32982 6.48619 9.72188 11.7938 13.0611 10.1648 9.68513 6.4398 11.1002 numMergedOcc 0
28 mol 238 unq 4 iso 0 dist 5.9216 6.4398 5.8333 8.82351 4.40419 6.22195 5.40359 9.90142 6.66971 11.1059 numMergedOcc 0
29 mol 238 unq 5 iso 0 dist 5.9216 6.4398 5.8333 8.82351 4.40419 6.22195 10.1648 10.7386 7.32982 12.7605 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 8.50864 6.17052 6.53154 9.05018 13.1523 7.14182 5.55137 11.9152 9.77666 9.33962 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 6.77938 8.59697 12.1218 8.03219 8.90322 4.67584 9.98105 14.5785 8.55558 11.7465 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 6.77938 8.59697 12.1218 6.9899 9.2872 7.32929 9.98105 14.5785 8.55558 5.85442 numMergedOcc 0
33 mol 259 unq 2 iso 0 dist 7.76676 8.59697 9.22203 8.03219 7.27192 4.67584 9.98105 10.4634 8.55558 11.7465 numMergedOcc 0
34 mol 259 unq 3 iso 0 dist 7.76676 8.59697 9.22203 6.9899 4.61451 7.32929 9.98105 10.4634 8.55558 5.85442 numMergedOcc 0
