0 mol 8 unq 0 iso 0 dist 7.70793 7.55301 8.94096 9.68072 11.4765 9.86938 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.70793 5.95206 9.07858 11.68 12.3138 8.16743 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 7.56303 10.6468 8.00865 13.9704 10.8881 9.37413 numMergedOcc 0
3 mol 13 unq 1 iso 0 dist 7.56303 6.28453 9.11447 13.9704 10.8881 9.18487 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 5.06773 7.91356 9.17518 4.97954 8.17152 7.23261 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 5.06773 7.91356 9.17518 9.20117 10.0357 8.96501 numMergedOcc 0
6 mol 44 unq 2 iso 0 dist 5.06773 7.91356 9.17518 8.72535 7.37043 9.4798 numMergedOcc 0
7 mol 44 unq 3 iso 0 dist 5.06773 3.92405 8.21833 4.97954 8.17152 6.20069 numMergedOcc 0
8 mol 44 unq 4 iso 0 dist 8.2444 13.347 9.17518 9.32074 8.17152 7.23261 numMergedOcc 0
9 mol 44 unq 5 iso 0 dist 8.2444 13.347 9.17518 13.5124 10.0357 8.96501 numMergedOcc 0
10 mol 44 unq 6 iso 0 dist 8.2444 13.347 9.17518 12.8419 7.37043 9.4798 numMergedOcc 0
11 mol 44 unq 7 iso 0 dist 8.2444 7.61459 8.21833 9.32074 8.17152 6.20069 numMergedOcc 0
12 mol 52 unq 0 iso 0 dist 8.96804 8.48826 8.65019 9.89949 5.45185 8.6668 numMergedOcc 0
13 mol 52 unq 1 iso 0 dist 7.23669 6.11606 8.65019 10.4083 5.45185 8.6668 numMergedOcc 0
14 mol 56 unq 0 iso 0 dist 8.58057 9.45587 5.86571 11.5632 7.39536 5.67098 numMergedOcc 0
15 mol 56 unq 1 iso 0 dist 8.58057 9.45587 5.86571 13.1601 11.4735 8.58218 numMergedOcc 0
16 mol 61 unq 0 iso 0 dist 6.62881 5.53349 8.94097 9.68759 5.81582 8.36115 numMergedOcc 0
17 mol 61 unq 1 iso 0 dist 9.32999 5.53349 9.66368 9.68759 4.83991 8.36115 numMergedOcc 0
18 mol 74 unq 0 iso 0 dist 8.46846 7.09879 8.2657 7.15667 5.62882 9.53176 numMergedOcc 0
19 mol 74 unq 1 iso 0 dist 7.37827 6.37457 8.2657 11.7854 5.62882 9.53176 numMergedOcc 0
20 mol 90 unq 0 iso 0 dist 8.98302 10.0339 7.30343 18.551 12.4094 9.16721 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 9.2746 6.21945 5.85818 12.5056 5.47002 8.95838 numMergedOcc 0
22 mol 119 unq 1 iso 0 dist 9.2746 6.21945 5.85818 14.3747 13.8865 9.47892 numMergedOcc 0
23 mol 130 unq 0 iso 0 dist 9.07483 6.91022 7.62145 5.17641 9.38503 6.01132 numMergedOcc 0
24 mol 154 unq 0 iso 0 dist 7.77159 11.0324 6.28417 10.3424 6.14702 8.46844 numMergedOcc 0
25 mol 163 unq 0 iso 0 dist 7.64106 10.9684 8.21476 9.36038 3.64474 8.70104 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 8.45863 5.23668 7.2498 6.22499 6.83037 9.39099 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 6.52129 12.4402 7.61203 12.3224 12.2456 9.46582 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 6.52129 12.4266 9.47845 12.3224 12.2456 9.77231 numMergedOcc 0
29 mol 248 unq 0 iso 0 dist 5.75155 5.28545 8.42446 7.11548 5.82647 8.97536 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 7.2551 6.4731 6.73126 13.5703 11.01 8.96092 numMergedOcc 0
