0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.68596 14.7759 13.0969 9.0379 16.7601 13.2603 6.7985 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.96553 8.33604 8.27181 8.53529 4.36226 11.4716 12.4076 10.9634 17.5554 7.03958 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 8.96553 8.33604 8.27181 8.53529 4.36226 11.4716 8.4069 9.62879 13.3876 7.18019 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 8.96553 8.33604 8.27181 8.53529 4.36226 11.4716 12.9016 12.4058 18.4127 8.44009 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 8.38064 8.21493 5.90976 7.07399 4.29582 6.33828 11.0528 9.88835 10.6943 5.89412 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 7.20519 8.78293 5.31524 7.75618 4.96411 6.2337 7.67038 10.4091 13.4721 8.40416 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 7.20519 8.23643 11.0832 7.75618 4.96411 14.4867 7.67038 10.4091 14.6255 8.40416 numMergedOcc 0
7 mol 19 unq 2 iso 0 dist 7.20519 7.82528 10.4988 7.75618 4.96411 11.4087 7.67038 10.4091 6.20943 8.40416 numMergedOcc 0
8 mol 19 unq 3 iso 0 dist 8.4674 6.20943 5.14627 8.40416 9.74255 11.4087 7.67038 4.54938 7.82528 7.75618 numMergedOcc 0
9 mol 19 unq 4 iso 0 dist 4.54938 8.78293 10.9543 7.75618 9.74255 6.2337 7.67038 8.4674 13.4721 8.40416 numMergedOcc 0
10 mol 19 unq 5 iso 0 dist 4.54938 8.23643 6.55187 7.75618 9.74255 14.4867 7.67038 8.4674 14.6255 8.40416 numMergedOcc 0
11 mol 19 unq 6 iso 0 dist 4.54938 7.82528 5.14627 7.75618 9.74255 11.4087 7.67038 8.4674 6.20943 8.40416 numMergedOcc 0
12 mol 19 unq 7 iso 0 dist 4.51865 6.20943 4.69858 8.40416 7.08342 11.4087 7.67038 6.864 7.82528 7.75618 numMergedOcc 0
13 mol 19 unq 8 iso 0 dist 4.51865 8.58657 6.74265 6.41423 4.64838 5.90856 5.80928 8.4674 9.58539 6.41575 numMergedOcc 0
14 mol 19 unq 9 iso 0 dist 6.864 8.78293 11.4401 7.75618 7.08342 6.2337 7.67038 4.51865 13.4721 8.40416 numMergedOcc 0
15 mol 19 unq 10 iso 0 dist 6.864 8.23643 12.3093 7.75618 7.08342 14.4867 7.67038 4.51865 14.6255 8.40416 numMergedOcc 0
16 mol 19 unq 11 iso 0 dist 6.864 7.82528 4.69858 7.75618 7.08342 11.4087 7.67038 4.51865 6.20943 8.40416 numMergedOcc 0
17 mol 19 unq 12 iso 0 dist 6.864 8.58657 5.5841 6.41423 4.97119 5.90856 5.80928 4.54938 9.58539 6.41575 numMergedOcc 0
18 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 15.5315 15.5324 20.8959 8.4051 numMergedOcc 0
19 mol 24 unq 1 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 10.0952 8.86116 12.4274 8.60554 numMergedOcc 0
20 mol 25 unq 0 iso 0 dist 7.31767 7.685 8.43188 8.6653 5.64303 12.9735 10.6808 12.4135 16.7035 7.92503 numMergedOcc 0
21 mol 25 unq 1 iso 0 dist 6.03987 7.685 10.3635 8.6653 5.82503 12.9735 10.6808 11.6743 16.7035 7.92503 numMergedOcc 0
22 mol 58 unq 0 iso 0 dist 6.86465 8.63333 6.47744 9.92355 5.78774 12.0055 5.30792 6.62496 11.5023 5.93884 numMergedOcc 0
23 mol 58 unq 1 iso 0 dist 6.86465 8.63333 6.47744 9.92355 5.78774 12.0055 5.35073 6.35756 8.89374 7.68678 numMergedOcc 0
24 mol 58 unq 2 iso 0 dist 6.62496 9.64665 4.67832 5.93884 5.78774 5.27642 5.30792 6.86465 11.4118 9.92355 numMergedOcc 0
25 mol 58 unq 3 iso 0 dist 6.62496 9.64665 4.67832 5.93884 5.78774 5.27642 4.81926 6.35756 9.66798 7.68678 numMergedOcc 0
26 mol 58 unq 4 iso 0 dist 6.35756 8.89374 6.47744 7.68678 5.78774 12.0055 5.35073 6.86465 8.63333 9.92355 numMergedOcc 0
27 mol 58 unq 5 iso 0 dist 6.35756 8.89374 6.47744 7.68678 5.78774 12.0055 4.81926 6.62496 11.5023 5.93884 numMergedOcc 0
28 mol 100 unq 0 iso 0 dist 9.60661 6.58204 10.9608 7.01812 5.80144 10.0891 5.88134 6.65086 7.75343 8.30845 numMergedOcc 0
29 mol 100 unq 1 iso 0 dist 7.17106 6.58204 5.01145 7.01812 8.4128 10.0891 5.88134 10.5134 7.75343 8.30845 numMergedOcc 0
30 mol 100 unq 2 iso 0 dist 9.35224 6.58204 5.69137 7.01812 10.0456 10.0891 5.88134 6.56369 7.75343 8.30845 numMergedOcc 0
31 mol 100 unq 3 iso 0 dist 7.47343 7.75343 15.209 8.30845 12.2861 10.0891 5.88134 12.0662 6.58204 7.01812 numMergedOcc 0
32 mol 100 unq 4 iso 0 dist 6.65086 7.75343 10.9608 8.30845 5.80144 10.0891 5.88134 9.60661 6.58204 7.01812 numMergedOcc 0
33 mol 100 unq 5 iso 0 dist 6.56369 7.75343 5.69137 8.30845 10.0456 10.0891 5.88134 9.35224 6.58204 7.01812 numMergedOcc 0
34 mol 100 unq 6 iso 0 dist 9.30209 7.75343 9.21622 8.30845 6.70236 10.0891 5.88134 10.5853 6.58204 7.01812 numMergedOcc 0
35 mol 134 unq 0 iso 0 dist 6.54501 8.6355 10.1448 7.80532 7.41674 14.1488 5.79898 9.89303 12.0514 5.83771 numMergedOcc 0
36 mol 134 unq 1 iso 0 dist 6.49416 8.6355 5.41704 7.80532 9.87376 14.1488 5.79898 9.93925 12.0514 5.83771 numMergedOcc 0
37 mol 156 unq 0 iso 0 dist 7.44554 9.36805 6.29785 9.44367 5.4555 10.143 5.56175 8.94056 13.1853 7.90267 numMergedOcc 0
38 mol 156 unq 1 iso 0 dist 7.44554 9.36805 6.29785 9.47433 11.9952 10.0003 5.76755 10.4649 8.47155 6.30021 numMergedOcc 0
39 mol 181 unq 0 iso 0 dist 5.98885 7.20046 5.4601 7.99195 6.6251 4.69841 8.88798 9.1374 10.2276 6.2479 numMergedOcc 0
40 mol 181 unq 1 iso 0 dist 5.98885 7.20046 5.4601 7.99195 6.6251 4.69841 12.6324 9.94371 10.3493 6.22122 numMergedOcc 0
41 mol 181 unq 2 iso 0 dist 5.98885 7.13543 10.0524 7.99195 6.6251 7.23063 8.88798 9.1374 10.7636 6.2479 numMergedOcc 0
42 mol 181 unq 3 iso 0 dist 5.98885 7.13543 10.0524 7.99195 6.6251 7.23063 12.6324 9.94371 13.1996 6.22122 numMergedOcc 0
43 mol 181 unq 4 iso 0 dist 9.09537 7.20046 6.14208 7.99195 10.09 4.69841 8.88798 15.0228 10.2276 6.2479 numMergedOcc 0
44 mol 181 unq 5 iso 0 dist 9.09537 7.20046 6.14208 7.99195 10.09 4.69841 12.6324 16.2058 10.3493 6.22122 numMergedOcc 0
45 mol 181 unq 6 iso 0 dist 9.09537 7.13543 5.95965 7.99195 10.09 7.23063 8.88798 15.0228 10.7636 6.2479 numMergedOcc 0
46 mol 181 unq 7 iso 0 dist 9.09537 7.13543 5.95965 7.99195 10.09 7.23063 12.6324 16.2058 13.1996 6.22122 numMergedOcc 0
47 mol 181 unq 8 iso 0 dist 7.81386 4.93785 6.7991 9.39829 7.20191 7.30555 8.85576 7.63312 10.1232 6.41453 numMergedOcc 0
48 mol 181 unq 9 iso 0 dist 7.63312 6.93764 4.80231 6.41453 7.20191 6.05477 8.85576 7.81386 11.4148 9.39829 numMergedOcc 0
49 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 9.55668 7.60081 13.128 9.89669 11.3258 12.3562 6.95126 numMergedOcc 0
50 mol 238 unq 0 iso 0 dist 5.72887 9.29858 13.069 9.24557 14.7883 10.3809 10.0191 13.5431 12.5477 7.57812 numMergedOcc 0
51 mol 249 unq 0 iso 0 dist 7.57994 8.83735 5.23473 5.48118 10.7772 10.639 5.3927 12.8752 13.5805 7.25858 numMergedOcc 0
52 mol 249 unq 1 iso 0 dist 6.18582 8.83735 7.38675 5.48118 7.04666 10.639 5.3927 11.2388 13.5805 7.25858 numMergedOcc 0
53 mol 278 unq 0 iso 0 dist 8.44326 6.35287 6.07447 8.00673 4.97614 7.83538 8.29447 10.6095 12.1774 6.62841 numMergedOcc 0
