0 mol 15 unq 0 iso 0 dist 6.82505 7.12903 5.51916 8.28153 3.78082 4.25929 5.55659 9.78051 8.96967 11.7266 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 4.51865 8.58657 6.74265 7.7312 4.44441 9.61438 4.69858 6.20943 10.7418 6.38574 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.864 8.58657 5.5841 7.7312 10.0411 9.61438 11.4401 8.78293 9.95011 17.3652 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 6.864 8.58657 5.5841 7.7312 10.0411 9.61438 12.3093 8.23643 13.6944 15.6781 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 6.864 8.58657 5.5841 7.7312 10.0411 9.61438 4.69858 7.82528 10.7418 6.38574 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.34347 6.73162 7.23546 7.98005 12.5438 8.62111 11.887 9.16962 15.0652 16.138 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.34347 6.73162 7.23546 8.31381 8.39015 9.18438 11.887 9.16962 15.0652 10.343 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 7.58835 9.20119 6.89191 8.27463 5.84319 3.82801 5.67689 6.34173 8.59109 9.44125 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.32874 8.26899 4.55117 9.4278 10.7675 13.4402 6.75888 6.40841 8.80108 13.2217 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 7.32874 6.40841 6.75888 8.34191 8.44881 3.8375 4.55117 8.26899 8.80108 8.88313 numMergedOcc 0
10 mol 58 unq 2 iso 0 dist 7.32874 6.40841 6.75888 6.39747 4.25144 6.11446 4.55117 8.26899 8.80108 5.48837 numMergedOcc 0
11 mol 58 unq 3 iso 0 dist 6.86465 8.63333 6.47744 9.23438 4.59417 4.43437 5.92889 9.58673 7.01363 8.98478 numMergedOcc 0
12 mol 58 unq 4 iso 0 dist 6.35756 8.89374 6.47744 7.17488 4.59417 4.43437 7.05413 9.58673 7.01363 8.98478 numMergedOcc 0
13 mol 58 unq 5 iso 0 dist 9.55426 8.26899 10.3782 9.4278 10.5901 13.4402 13.1021 9.73139 12.8396 19.1225 numMergedOcc 0
14 mol 58 unq 6 iso 0 dist 9.55426 8.26899 10.3782 9.4278 10.5901 13.4402 6.75888 6.31428 8.80108 13.2217 numMergedOcc 0
15 mol 72 unq 0 iso 0 dist 9.96708 6.77912 7.11552 4.86198 10.7434 10.4337 9.0131 7.321 9.19459 10.3769 numMergedOcc 0
16 mol 72 unq 1 iso 0 dist 9.78528 9.02278 11.6894 6.62699 10.7434 7.82564 6.11922 7.321 13.4823 10.3769 numMergedOcc 0
17 mol 88 unq 0 iso 0 dist 9.36773 8.66514 8.4283 9.07128 10.8406 3.99025 6.95868 9.2603 13.649 15.0007 numMergedOcc 0
18 mol 88 unq 1 iso 0 dist 9.36773 8.66514 8.4283 6.65615 4.47193 6.69123 6.95868 9.2603 13.649 9.08952 numMergedOcc 0
19 mol 88 unq 2 iso 0 dist 9.36773 9.25235 5.37521 9.07128 10.8406 6.08504 6.95868 9.2603 12.48 15.0007 numMergedOcc 0
20 mol 88 unq 3 iso 0 dist 9.36773 9.25235 5.37521 6.65615 4.47193 3.77436 6.95868 9.2603 12.48 9.08952 numMergedOcc 0
21 mol 127 unq 0 iso 0 dist 9.30299 8.59981 14.085 5.39356 12.7606 6.92548 4.77464 9.81878 6.3244 7.79077 numMergedOcc 0
22 mol 127 unq 1 iso 0 dist 9.30299 8.59981 14.085 9.92746 12.6193 16.8777 4.77464 9.81878 6.3244 14.5349 numMergedOcc 0
23 mol 127 unq 2 iso 0 dist 9.30299 7.34519 13.1312 5.39356 12.7606 5.87751 4.77464 9.81878 11.7518 7.79077 numMergedOcc 0
24 mol 127 unq 3 iso 0 dist 9.30299 7.34519 13.1312 9.92746 12.6193 5.08112 4.77464 9.81878 11.7518 14.5349 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.81386 7.98142 9.53462 8.29467 6.13927 9.55459 6.7991 4.93785 12.2455 6.91878 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 7.81386 7.37327 11.1462 8.29467 6.13927 7.66761 6.7991 4.93785 11.691 6.91878 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 7.63312 7.98142 9.60512 8.29467 13.2274 9.55459 4.80231 6.93764 10.7841 13.0606 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 7.63312 7.37327 13.3389 8.29467 13.2274 7.66761 4.80231 6.93764 11.1129 13.0606 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 8.08965 4.75609 14.2299 4.65302 8.21247 11.9287 9.11149 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 7.69895 8.50864 10.1857 7.79063 6.19721 4.40718 6.48757 6.07192 13.4404 10.7209 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 5.30224 8.37865 5.31048 9.18798 5.96249 10.5148 4.99891 6.77938 11.4462 8.22608 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 5.30224 8.37865 5.31048 9.18798 5.96249 10.5148 5.32839 7.76676 9.64797 12.4194 numMergedOcc 0
33 mol 259 unq 2 iso 0 dist 5.30224 8.37865 5.31048 8.25897 5.97386 11.0001 4.99891 6.77938 11.4462 5.23503 numMergedOcc 0
34 mol 259 unq 3 iso 0 dist 5.30224 8.37865 5.31048 8.25897 5.97386 11.0001 5.32839 7.76676 9.64797 9.61028 numMergedOcc 0
