0 mol 0 unq 0 iso 0 dist 9.6994 8.13129 6.40255 14.9294 15.3236 9.99338 12.5416 12.9149 7.05033 9.72725 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.07223 6.40255 15.247 15.3236 9.99338 15.8082 12.9149 7.05033 9.72725 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.60499 7.5706 10.5551 9.0379 10.6581 6.28925 10.25 15.7311 5.35168 9.87885 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 9.60499 7.5706 10.5551 15.4949 18.3807 8.70159 10.25 15.7311 5.35168 6.1206 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 9.60499 7.5706 10.5551 15.4949 18.3807 8.70159 13.6071 20.2743 10.1219 7.67927 numMergedOcc 0
5 mol 7 unq 3 iso 0 dist 8.41585 6.28925 10.6847 13.2247 12.2333 8.70159 9.87885 12.8323 5.35168 6.1206 numMergedOcc 0
6 mol 7 unq 4 iso 0 dist 8.41585 6.28925 10.6847 13.2247 12.2333 8.70159 14.1836 16.5681 10.1219 7.67927 numMergedOcc 0
7 mol 7 unq 5 iso 0 dist 7.10621 8.70159 4.87279 13.2247 10.5461 6.28925 6.1206 7.12508 5.35168 9.87885 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.80331 6.79185 11.1338 5.06502 10.5523 8.92291 10.0168 10.8828 10.0882 6.66407 numMergedOcc 0
9 mol 43 unq 1 iso 0 dist 6.20293 6.79185 5.54797 5.06502 5.73819 8.92291 10.0168 5.07458 10.0882 6.66407 numMergedOcc 0
10 mol 43 unq 2 iso 0 dist 8.93915 8.37962 5.54797 5.89973 5.73819 8.92291 10.9975 5.07458 10.0882 6.66407 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 9.38498 9.33919 15.9091 5.4148 10.2049 9.79143 12.2276 18.7673 12.8099 8.68662 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 9.38498 9.33919 15.9091 5.4148 10.2049 9.79143 9.73086 17.4121 10.4668 7.4369 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 9.38498 9.33919 15.9091 14.9342 20.257 6.43377 13.3207 19.0013 4.25755 5.5087 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 9.38498 9.33919 15.9091 14.9342 20.257 6.43377 14.498 21.9204 6.08046 6.08682 numMergedOcc 0
15 mol 73 unq 4 iso 0 dist 9.96396 9.33919 7.9151 5.4148 6.19304 9.79143 12.2276 6.20232 12.8099 8.68662 numMergedOcc 0
16 mol 73 unq 5 iso 0 dist 9.96396 9.33919 7.9151 5.4148 6.19304 9.79143 9.73086 5.70116 10.4668 7.4369 numMergedOcc 0
17 mol 73 unq 6 iso 0 dist 9.96396 9.33919 7.9151 14.9342 8.70481 6.43377 13.3207 11.2069 4.25755 5.5087 numMergedOcc 0
18 mol 73 unq 7 iso 0 dist 9.96396 9.33919 7.9151 14.9342 8.70481 6.43377 14.498 10.6713 6.08046 6.08682 numMergedOcc 0
19 mol 73 unq 8 iso 0 dist 6.19304 9.79143 7.9151 5.4148 9.96396 9.33919 7.4369 5.70116 10.4668 9.73086 numMergedOcc 0
20 mol 73 unq 9 iso 0 dist 6.19304 9.79143 7.9151 13.3558 8.70481 6.43377 13.8368 11.2069 4.25755 5.5087 numMergedOcc 0
21 mol 73 unq 10 iso 0 dist 6.19304 9.79143 7.9151 13.3558 8.70481 6.43377 14.5999 10.6713 6.08046 6.08682 numMergedOcc 0
22 mol 73 unq 11 iso 0 dist 8.70481 6.43377 7.9151 14.9342 9.96396 9.33919 12.8207 5.70116 10.4668 9.73086 numMergedOcc 0
23 mol 73 unq 12 iso 0 dist 8.70481 6.43377 7.9151 13.3558 6.19304 9.79143 13.8931 6.20232 12.8099 8.68662 numMergedOcc 0
24 mol 73 unq 13 iso 0 dist 8.70481 6.43377 7.9151 13.3558 6.19304 9.79143 12.8207 5.70116 10.4668 7.4369 numMergedOcc 0
25 mol 73 unq 14 iso 0 dist 9.75218 9.33919 5.44172 5.4148 11.6369 9.79143 12.2276 17.2422 12.8099 8.68662 numMergedOcc 0
26 mol 73 unq 15 iso 0 dist 9.75218 9.33919 5.44172 5.4148 11.6369 9.79143 9.73086 14.844 10.4668 7.4369 numMergedOcc 0
27 mol 73 unq 16 iso 0 dist 9.75218 9.33919 5.44172 14.9342 10.1207 6.43377 13.3207 6.19168 4.25755 5.5087 numMergedOcc 0
28 mol 73 unq 17 iso 0 dist 9.75218 9.33919 5.44172 14.9342 10.1207 6.43377 14.498 10.532 6.08046 6.08682 numMergedOcc 0
29 mol 88 unq 0 iso 0 dist 8.31336 9.36032 6.81076 5.57085 9.36773 6.066 12.785 12.1193 6.29943 7.80898 numMergedOcc 0
30 mol 100 unq 0 iso 0 dist 7.17106 8.20656 8.07089 10.8586 10.1489 4.5985 15.6594 9.81953 10.3433 9.90751 numMergedOcc 0
31 mol 100 unq 1 iso 0 dist 7.17106 8.20656 8.07089 10.8586 10.1489 4.5985 10.5432 4.03277 8.59989 9.21662 numMergedOcc 0
32 mol 119 unq 0 iso 0 dist 8.73993 6.69217 11.3981 9.93257 16.4353 9.70093 7.64052 9.68677 10.9729 8.95212 numMergedOcc 0
33 mol 119 unq 1 iso 0 dist 6.18601 9.70093 10.6133 9.93257 9.72413 6.69217 8.95212 4.39676 10.9729 7.64052 numMergedOcc 0
34 mol 133 unq 0 iso 0 dist 7.11802 9.64695 6.56917 8.18495 8.00618 4.51266 12.5855 15.0115 13.2024 8.77023 numMergedOcc 0
35 mol 234 unq 0 iso 0 dist 8.34494 7.72403 10.3378 5.88703 12.9605 6.35438 11.6391 14.898 4.76962 7.81215 numMergedOcc 0
36 mol 234 unq 1 iso 0 dist 8.34494 7.72403 10.3378 15.2225 19.889 9.57132 11.6391 14.898 4.76962 5.64285 numMergedOcc 0
37 mol 234 unq 2 iso 0 dist 6.56247 7.72403 8.83842 5.88703 9.45496 6.35438 11.6391 12.4252 4.76962 7.81215 numMergedOcc 0
38 mol 234 unq 3 iso 0 dist 6.56247 7.72403 8.83842 15.2225 17.458 9.57132 11.6391 12.4252 4.76962 5.64285 numMergedOcc 0
39 mol 234 unq 4 iso 0 dist 9.36357 7.72403 5.43327 5.88703 6.7625 6.35438 11.6391 5.75498 4.76962 7.81215 numMergedOcc 0
40 mol 234 unq 5 iso 0 dist 9.36357 7.72403 5.43327 15.2225 10.701 9.57132 11.6391 5.75498 4.76962 5.64285 numMergedOcc 0
41 mol 234 unq 6 iso 0 dist 9.45496 6.35438 8.83842 10.2693 17.458 9.57132 7.81215 12.4252 4.76962 5.64285 numMergedOcc 0
42 mol 234 unq 7 iso 0 dist 6.7625 6.35438 5.43327 10.2693 10.701 9.57132 7.81215 5.75498 4.76962 5.64285 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 7.56915 6.32856 11.5556 9.15171 13.9359 8.11169 11.9912 11.4471 10.5817 9.30212 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 7.56915 6.32856 11.5556 9.15171 13.9359 8.11169 12.8334 16.9539 14.0768 6.4611 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 8.49997 6.32856 13.5073 9.15171 17.2858 8.11169 11.9912 17.1519 10.5817 9.30212 numMergedOcc 0
46 mol 274 unq 3 iso 0 dist 8.49997 6.32856 13.5073 9.15171 17.2858 8.11169 12.8334 19.9648 14.0768 6.4611 numMergedOcc 0
