0 mol 7 unq 0 iso 0 dist 5.72491 9.67164 8.0744 10.789 9.55056 14.144 4.87279 7.12105 8.48947 8.50789 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.72491 9.67164 8.0744 10.515 7.45262 8.81608 4.87279 7.12105 8.48947 7.58143 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.88043 5.99459 8.0744 12.2708 9.55056 14.144 10.6847 7.12105 8.48947 8.50789 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.88043 5.99459 8.0744 6.06176 7.45262 8.81608 10.6847 7.12105 8.48947 7.58143 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 6.82379 6.56356 8.64248 13.7792 8.94096 17.0548 9.6474 8.3997 15.0755 6.84097 numMergedOcc 0
5 mol 8 unq 1 iso 0 dist 6.82379 6.56356 8.64248 15.4959 9.07858 15.5373 9.6474 8.3997 15.0755 14.5081 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 7.05346 8.30653 4.3947 13.5628 9.82483 13.9961 4.86982 7.51584 6.83929 15.0684 numMergedOcc 0
7 mol 13 unq 0 iso 0 dist 8.43325 9.45635 9.75022 8.66829 8.00865 10.3157 7.43378 8.81649 5.3927 5.47592 numMergedOcc 0
8 mol 13 unq 1 iso 0 dist 8.43325 9.45635 9.75022 14.2112 9.11447 17.3812 7.43378 8.81649 5.3927 14.0992 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 6.77886 9.03564 10.5332 10.9467 5.86571 16.2662 11.2854 8.76402 18.6141 4.59391 numMergedOcc 0
10 mol 56 unq 1 iso 0 dist 6.77886 9.03564 10.5332 10.9467 5.86571 16.2662 5.19333 5.6727 10.046 8.7005 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 7.72144 8.33439 14.4682 13.9336 9.47362 17.5983 15.8067 9.79706 21.6963 6.38905 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 7.72144 8.33439 14.4682 13.9336 9.47362 17.5983 12.4119 9.31487 20.2535 13.1574 numMergedOcc 0
13 mol 154 unq 2 iso 0 dist 7.72144 8.33439 14.4682 6.53652 6.28417 14.6576 15.8067 9.79706 21.6963 14.4117 numMergedOcc 0
14 mol 154 unq 3 iso 0 dist 7.72144 8.33439 14.4682 6.53652 6.28417 14.6576 12.4119 9.31487 20.2535 8.94904 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 7.35824 9.63417 5.68406 11.1651 7.01126 11.9429 5.32538 9.58615 11.5225 10.9284 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 9.17364 9.63417 9.31641 11.1651 6.58434 11.9429 5.32538 6.83568 11.5225 10.9284 numMergedOcc 0
17 mol 178 unq 0 iso 0 dist 4.92088 9.11204 7.79894 5.25267 5.98771 11.7594 6.39077 7.88301 14.7878 4.74632 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 7.63018 8.63693 6.75621 10.9823 6.4829 11.516 12.1506 8.85757 15.5259 8.36689 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 6.04162 9.19754 5.82131 8.16326 9.42738 13.8261 8.59461 6.74637 10.8114 4.59547 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 6.14323 8.29262 5.82131 12.3807 9.42738 13.8261 11.697 6.74637 10.8114 4.59547 numMergedOcc 0
