0 mol 14 unq 0 iso 0 dist 7.94714 11.2303 9.04767 10.556 4.53725 9.58196 9.50202 9.6726 5.76302 8.84686 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.06275 10.4413 6.20293 12.0618 5.06502 5.73819 14.5833 10.0168 5.07458 6.66407 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 5.84171 6.20293 6.84521 5.06502 5.73819 6.59001 10.0168 5.07458 6.66407 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 6.78532 5.84171 8.93915 6.84521 5.89973 5.73819 6.59001 10.9975 5.07458 6.66407 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 12.4928 4.81926 6.35756 6.69301 9.22598 9.87158 8.96727 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.81637 11.9429 6.62496 12.4928 4.81926 6.35756 10.6705 9.55996 5.86526 8.01308 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.43143 16.2349 9.96708 16.5383 8.24309 9.78528 12.6194 7.12321 7.47371 6.21799 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 9.43143 16.2349 9.96708 16.5383 8.24309 9.78528 15.182 9.35457 9.67587 5.03251 numMergedOcc 0
8 mol 72 unq 2 iso 0 dist 9.43143 16.2349 9.96708 16.5383 8.24309 9.78528 18.1233 12.1131 7.07356 7.66093 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.07365 14.1188 7.27724 12.3834 8.41707 8.03644 18.3404 15.6447 15.6249 8.27883 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.07365 14.1188 7.27724 12.3834 8.41707 8.03644 16.5701 14.0772 12.4896 5.75428 numMergedOcc 0
11 mol 95 unq 2 iso 0 dist 8.07365 14.1188 7.27724 12.3834 8.41707 8.03644 13.3438 14.1515 14.2178 8.57395 numMergedOcc 0
12 mol 95 unq 3 iso 0 dist 8.07365 14.1188 7.27724 12.3834 8.41707 8.03644 11.578 10.3132 8.78079 9.85409 numMergedOcc 0
13 mol 95 unq 4 iso 0 dist 7.90775 4.16047 9.03572 11.3191 16.6055 8.03644 12.905 19.7448 11.3215 9.3948 numMergedOcc 0
14 mol 95 unq 5 iso 0 dist 7.90775 4.16047 9.03572 11.3191 16.6055 8.03644 5.87066 11.97 5.06946 9.74607 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 9.23803 6.32175 8.58044 11.1563 7 7.34473 12.8917 11.0751 6.73011 6.29161 numMergedOcc 0
16 mol 109 unq 1 iso 0 dist 9.23803 6.32175 8.58044 11.1563 7 7.34473 18.2928 14.3511 13.0886 7.86666 numMergedOcc 0
17 mol 109 unq 2 iso 0 dist 8.05028 6.32175 9.97763 11.1563 8.40993 7.34473 12.8917 13.6787 6.73011 6.29161 numMergedOcc 0
18 mol 109 unq 3 iso 0 dist 8.05028 6.32175 9.97763 11.1563 8.40993 7.34473 18.2928 15.7916 13.0886 7.86666 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 9.94179 6.70853 9.52634 12.2738 7.6656 7.24514 11.2682 13.5471 5.03174 8.26547 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 8.66715 14.0905 7.11802 9.00172 8.18495 8.00618 7.44092 12.5855 15.0115 8.77023 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 8.95433 11.0811 7.11802 13.7786 8.18495 8.00618 20.3835 12.5855 15.0115 8.77023 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 10.9216 5.49782 8.94367 15.9796 7.93372 8.06642 7.21868 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 10.9216 5.49782 9.86662 15.9796 7.93372 4.00092 7.21868 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 4.9155 10.879 6.49416 10.9216 8.80819 8.94367 15.9796 11.988 8.06642 7.21868 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 4.9155 10.879 6.49416 8.84656 5.00817 6.37586 14.2595 9.55584 6.95573 9.33924 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 4.9155 10.879 6.49416 8.84656 5.00817 6.37586 15.9796 11.988 8.06642 7.93372 numMergedOcc 0
27 mol 134 unq 5 iso 0 dist 8.49987 10.9399 6.49416 14.7559 8.80819 8.94367 18.0881 11.988 8.06642 7.21868 numMergedOcc 0
28 mol 134 unq 6 iso 0 dist 8.49987 10.9399 6.49416 13.0189 5.00817 6.37586 14.9038 9.55584 6.95573 9.33924 numMergedOcc 0
29 mol 134 unq 7 iso 0 dist 8.49987 10.9399 6.49416 13.0189 5.00817 6.37586 18.0881 11.988 8.06642 7.93372 numMergedOcc 0
30 mol 134 unq 8 iso 0 dist 9.42271 7.07625 6.49416 9.79337 8.80819 8.94367 11.6261 11.988 8.06642 7.21868 numMergedOcc 0
31 mol 134 unq 9 iso 0 dist 9.42271 7.07625 6.49416 10.5814 5.00817 6.37586 13.8316 9.55584 6.95573 9.33924 numMergedOcc 0
32 mol 134 unq 10 iso 0 dist 9.42271 7.07625 6.49416 10.5814 5.00817 6.37586 11.6261 11.988 8.06642 7.93372 numMergedOcc 0
33 mol 134 unq 11 iso 0 dist 5.79157 13.0109 9.86662 9.87619 6.81259 8.94367 7.97297 8.69531 7.41373 9.33094 numMergedOcc 0
34 mol 134 unq 12 iso 0 dist 5.79157 14.1608 9.71307 9.87619 6.81259 6.37586 7.97297 8.69531 10.8635 9.33094 numMergedOcc 0
35 mol 142 unq 0 iso 0 dist 8.86346 16.7609 9.2313 13.95 5.32922 5.31024 13.5413 7.81207 4.67662 6.14151 numMergedOcc 0
36 mol 142 unq 1 iso 0 dist 8.86346 13.5268 7.73169 13.95 5.32922 7.26382 13.5413 7.81207 5.81599 6.14151 numMergedOcc 0
37 mol 142 unq 2 iso 0 dist 4.93681 12.8283 9.2313 9.86383 5.32922 5.31024 9.85239 7.81207 4.67662 6.14151 numMergedOcc 0
38 mol 142 unq 3 iso 0 dist 4.93681 10.1677 7.73169 9.86383 5.32922 7.26382 9.85239 7.81207 5.81599 6.14151 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 5.77925 6.59536 8.03456 11.8216 7.28249 9.81562 10.4597 10.1317 4.27181 9.3206 numMergedOcc 0
40 mol 236 unq 1 iso 0 dist 5.77925 8.93012 6.84306 11.8216 7.28249 7.68742 10.4597 10.1317 4.89609 9.3206 numMergedOcc 0
41 mol 236 unq 2 iso 0 dist 5.77925 12.1686 9.99038 11.8216 7.28249 6.27581 10.4597 10.1317 10.5774 9.3206 numMergedOcc 0
42 mol 236 unq 3 iso 0 dist 5.77925 10.5925 8.35971 10.4879 7.43758 8.04248 12.816 11.5798 4.66414 8.23087 numMergedOcc 0
43 mol 252 unq 0 iso 0 dist 6.17985 6.02958 8.33025 13.0333 14.9102 7.19638 10.8614 13.1298 7.40852 7.15764 numMergedOcc 0
