0 mol 19 unq 0 iso 0 dist 7.20519 7.82528 10.4988 5.5841 9.80108 10.7418 10.0411 14.2009 6.38574 9.61438 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.20519 9.80108 5.5841 5.31524 8.78293 9.95011 10.3996 11.0464 7.40236 8.34761 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.20519 9.80108 5.5841 11.0832 8.23643 13.6944 10.3996 11.0464 7.40236 18.4046 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.20519 9.80108 5.5841 10.4988 7.82528 10.7418 10.3996 11.0464 7.40236 16.2086 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 4.51865 6.20943 4.69858 6.74265 8.58657 10.7418 4.44441 7.7312 6.38574 9.61438 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 4.51865 8.58657 6.74265 4.69858 6.20943 10.7418 12.323 11.6815 7.40236 16.2086 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 6.864 7.82528 4.69858 5.5841 8.58657 10.7418 10.0411 7.7312 6.38574 9.61438 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 6.864 8.58657 5.5841 11.4401 8.78293 9.95011 12.323 11.0464 7.40236 8.34761 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 6.864 8.58657 5.5841 12.3093 8.23643 13.6944 12.323 11.0464 7.40236 18.4046 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 6.864 8.58657 5.5841 4.69858 7.82528 10.7418 12.323 11.0464 7.40236 16.2086 numMergedOcc 0
10 mol 26 unq 0 iso 0 dist 8.34347 9.16962 11.887 7.23546 6.73162 15.0652 15.962 15.4381 7.84204 20.1475 numMergedOcc 0
11 mol 45 unq 0 iso 0 dist 7.58835 6.34173 5.67689 6.89191 9.20119 8.59109 5.84319 8.27463 9.44125 3.82801 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 7.32874 8.26899 4.55117 6.75888 6.40841 8.80108 8.44881 8.34191 8.88313 3.8375 numMergedOcc 0
13 mol 58 unq 1 iso 0 dist 7.32874 8.26899 4.55117 6.75888 6.40841 8.80108 4.25144 6.39747 5.48837 6.11446 numMergedOcc 0
14 mol 58 unq 2 iso 0 dist 6.86465 9.58673 5.92889 6.47744 8.63333 7.01363 4.59417 9.23438 8.98478 4.43437 numMergedOcc 0
15 mol 58 unq 3 iso 0 dist 6.62496 9.58673 10.2241 4.67832 9.64665 13.848 4.59417 9.9105 8.98478 6.1443 numMergedOcc 0
16 mol 58 unq 4 iso 0 dist 6.35756 9.58673 7.05413 6.47744 8.89374 7.01363 4.59417 7.17488 8.98478 4.43437 numMergedOcc 0
17 mol 58 unq 5 iso 0 dist 9.55426 8.26899 10.3782 13.1021 9.73139 12.8396 8.44881 9.79064 8.88313 5.87305 numMergedOcc 0
18 mol 58 unq 6 iso 0 dist 9.55426 8.26899 10.3782 13.1021 9.73139 12.8396 4.25144 10.307 5.48837 11.3972 numMergedOcc 0
19 mol 58 unq 7 iso 0 dist 9.55426 8.26899 10.3782 6.75888 6.31428 8.80108 8.44881 9.79064 8.88313 3.8375 numMergedOcc 0
20 mol 58 unq 8 iso 0 dist 9.55426 8.26899 10.3782 6.75888 6.31428 8.80108 4.25144 10.307 5.48837 6.11446 numMergedOcc 0
21 mol 88 unq 0 iso 0 dist 9.36773 9.2603 6.95868 8.4283 8.66514 13.649 4.47193 6.65615 9.08952 6.69123 numMergedOcc 0
22 mol 88 unq 1 iso 0 dist 9.36773 9.2603 6.95868 5.37521 9.25235 12.48 4.47193 6.65615 9.08952 3.77436 numMergedOcc 0
23 mol 114 unq 0 iso 0 dist 7.35754 8.68821 5.33327 4.77056 7.52743 7.36816 10.5728 10.7946 9.26486 5.80637 numMergedOcc 0
24 mol 127 unq 0 iso 0 dist 9.30299 8.59981 14.085 4.77464 9.81878 6.3244 14.8455 17.6043 9.70065 10.1788 numMergedOcc 0
25 mol 127 unq 1 iso 0 dist 9.30299 9.81878 4.77464 14.085 8.59981 6.3244 12.7606 5.39356 7.79077 6.92548 numMergedOcc 0
26 mol 127 unq 2 iso 0 dist 9.30299 9.81878 4.77464 13.1312 7.34519 11.7518 12.7606 5.39356 7.79077 5.87751 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 5.98885 6.71012 9.14057 5.4601 7.20046 9.94131 11.618 15.9184 7.61421 15.5459 numMergedOcc 0
28 mol 181 unq 1 iso 0 dist 5.98885 6.71012 9.14057 10.0524 7.13543 12.8673 11.618 15.9184 7.61421 19.9421 numMergedOcc 0
29 mol 181 unq 2 iso 0 dist 9.15386 6.71012 11.6919 8.25067 9.6668 9.40622 11.618 17.4077 7.61421 10.4087 numMergedOcc 0
30 mol 181 unq 3 iso 0 dist 7.81386 4.93785 6.7991 9.53462 7.98142 12.2455 6.13927 8.29467 6.91878 9.55459 numMergedOcc 0
31 mol 181 unq 4 iso 0 dist 7.81386 4.93785 6.7991 11.1462 7.37327 11.691 6.13927 8.29467 6.91878 7.66761 numMergedOcc 0
32 mol 209 unq 0 iso 0 dist 7.56373 9.52027 6.43758 7.19056 7.95911 11.5217 5.36295 9.98952 8.62439 11.9213 numMergedOcc 0
33 mol 214 unq 0 iso 0 dist 8.85478 7.46831 6.67959 8.47007 6.97182 11.7443 8.3225 12.5607 9.86587 13.4169 numMergedOcc 0
34 mol 214 unq 1 iso 0 dist 8.85478 7.46831 6.67959 12.8334 6.1175 12.7646 8.3225 12.5607 9.86587 16.6257 numMergedOcc 0
35 mol 235 unq 0 iso 0 dist 5.4638 8.21247 4.65302 9.66021 9.58736 11.9287 4.75609 8.08965 9.11149 14.2299 numMergedOcc 0
36 mol 239 unq 0 iso 0 dist 7.00034 7.20082 7.04058 6.26168 7.39747 6.34801 8.19606 10.8831 9.82674 3.89756 numMergedOcc 0
37 mol 239 unq 1 iso 0 dist 7.00034 7.20082 7.04058 5.39146 8.1777 9.95595 8.19606 10.8831 9.82674 4.97478 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 5.30224 8.37865 5.31048 4.99891 6.77938 11.4462 9.53031 11.1801 9.28024 14.5122 numMergedOcc 0
39 mol 259 unq 1 iso 0 dist 5.30224 8.37865 5.31048 5.32839 7.76676 9.64797 9.53031 11.1801 9.28024 12.5063 numMergedOcc 0
40 mol 259 unq 2 iso 0 dist 5.30224 6.77938 4.99891 5.31048 8.37865 11.4462 5.96249 9.18798 8.22608 10.5148 numMergedOcc 0
41 mol 259 unq 3 iso 0 dist 5.30224 6.77938 4.99891 5.31048 8.37865 11.4462 5.97386 8.25897 5.23503 11.0001 numMergedOcc 0
42 mol 259 unq 4 iso 0 dist 5.30224 7.76676 5.32839 5.31048 8.37865 9.64797 5.97386 8.25897 9.61028 11.0001 numMergedOcc 0
