0 mol 0 unq 0 iso 0 dist 6.80636 9.15248 8.31596 5.56852 5.88757 4.22598 13.3498 8.8123 6.3267 8.66548 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.23213 10.3034 6.3267 12.9149 8.66548 4.22598 15.944 8.8123 8.31596 5.88757 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.85412 5.60154 9.29529 5.84314 9.71516 3.91075 6.33889 5.80437 7.2199 9.81658 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.33889 5.60154 7.2199 5.84314 9.81658 3.91075 6.85412 5.80437 9.29529 9.71516 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 6.33889 4.61049 6.9513 5.84314 9.81658 8.25089 6.85412 5.80437 10.3656 9.71516 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 6.33889 6.64015 9.16116 5.84314 9.81658 12.0874 6.85412 5.80437 11.0149 9.71516 numMergedOcc 0
6 mol 9 unq 4 iso 0 dist 6.33889 13.7377 8.47109 5.84314 9.81658 14.6279 6.85412 5.80437 13.0178 9.71516 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 9.33535 6.78077 8.80108 9.53718 7.03126 11.0945 17.7263 14.2885 16.5169 9.68228 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 8.26899 6.75888 8.80108 5.61579 7.03126 11.0945 10.947 14.2885 16.5169 9.68228 numMergedOcc 0
9 mol 72 unq 0 iso 0 dist 8.624 6.00418 9.19459 5.72408 9.37102 5.11318 9.99431 6.31884 11.7653 8.8184 numMergedOcc 0
10 mol 72 unq 1 iso 0 dist 8.624 6.00418 9.19459 5.72408 9.37102 5.11318 10.0983 4.64409 8.59747 7.93683 numMergedOcc 0
11 mol 72 unq 2 iso 0 dist 8.624 6.00418 9.19459 3.94376 5.4605 6.74416 9.99431 6.31884 11.7653 6.1906 numMergedOcc 0
12 mol 72 unq 3 iso 0 dist 8.624 6.00418 9.19459 3.94376 5.4605 6.74416 10.0983 4.64409 8.59747 6.7272 numMergedOcc 0
13 mol 72 unq 4 iso 0 dist 8.624 6.00418 9.19459 6.19288 6.53824 10.7904 9.99431 6.31884 11.7653 7.67686 numMergedOcc 0
14 mol 72 unq 5 iso 0 dist 6.77912 9.0131 9.19459 10.0679 9.37102 5.11318 10.4226 6.31884 11.7653 8.8184 numMergedOcc 0
15 mol 72 unq 6 iso 0 dist 6.77912 9.0131 9.19459 10.0679 9.37102 5.11318 10.4676 4.64409 8.59747 7.93683 numMergedOcc 0
16 mol 72 unq 7 iso 0 dist 6.77912 9.0131 9.19459 5.69391 5.4605 6.74416 10.4226 6.31884 11.7653 6.1906 numMergedOcc 0
17 mol 72 unq 8 iso 0 dist 6.77912 9.0131 9.19459 5.69391 5.4605 6.74416 10.4676 4.64409 8.59747 6.7272 numMergedOcc 0
18 mol 72 unq 9 iso 0 dist 6.77912 9.0131 9.19459 4.03844 6.53824 10.7904 10.4226 6.31884 11.7653 7.67686 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 7.39644 5.40375 7.37901 7.10286 5.36254 4.48516 11.5473 5.68272 11.3251 7.29911 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 7.36102 6.34186 7.37901 4.91785 5.36254 4.48516 9.38946 5.68272 11.3251 7.29911 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 8.45368 11.1059 8.74171 4.72944 5.461 7.09198 11.0791 6.04429 12.9507 8.65196 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 9.59129 12.2579 8.74171 10.1881 5.461 7.09198 6.0965 6.04429 12.9507 8.65196 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 7.17547 4.54272 8.57853 15.6802 8.61306 16.2592 9.29802 4.63933 12.0985 9.59426 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 7.17547 10.2673 6.75035 15.6802 8.61306 10.1772 9.29802 4.63933 10.9643 9.59426 numMergedOcc 0
25 mol 218 unq 2 iso 0 dist 7.13323 6.8949 8.57853 13.7327 8.61306 16.2592 9.50586 4.63933 12.0985 9.59426 numMergedOcc 0
26 mol 218 unq 3 iso 0 dist 7.13323 6.60235 6.75035 13.7327 8.61306 10.1772 9.50586 4.63933 10.9643 9.59426 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 8.19953 7.67202 4.55996 5.13732 5.73591 5.93269 11.5717 4.74813 9.17104 8.55345 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 9.5707 5.56749 8.49841 3.95629 8.27411 6.00588 7.85175 5.32617 10.0446 7.36208 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 9.5707 5.56749 8.49841 15.9732 6.96257 14.8966 12.5293 6.31377 13.819 6.86569 numMergedOcc 0
30 mol 234 unq 2 iso 0 dist 9.5707 12.1076 9.6101 3.95629 8.27411 13.9373 7.85175 5.32617 10.7048 7.36208 numMergedOcc 0
31 mol 234 unq 3 iso 0 dist 9.5707 12.1076 9.6101 15.9732 6.96257 10.72 12.5293 6.31377 12.2448 6.86569 numMergedOcc 0
32 mol 234 unq 4 iso 0 dist 6.16063 5.9221 8.49841 13.1872 9.11572 11.8229 13.2498 12.4341 13.7038 9.49229 numMergedOcc 0
33 mol 234 unq 5 iso 0 dist 6.16063 5.9221 8.49841 13.1872 9.11572 11.8229 11.4691 10.9755 9.6101 7.20293 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 8.96531 4.65297 6.65088 5.79187 6.85253 6.29757 13.9201 6.44245 11.4385 9.38131 numMergedOcc 0
35 mol 238 unq 1 iso 0 dist 8.96531 4.65297 6.65088 5.79187 6.85253 6.29757 10.5309 13.0634 9.0378 9.08687 numMergedOcc 0
36 mol 238 unq 2 iso 0 dist 7.02475 8.82861 6.65088 10.4966 6.85253 6.29757 6.55759 6.44245 11.4385 9.38131 numMergedOcc 0
37 mol 238 unq 3 iso 0 dist 7.02475 8.82861 6.65088 10.4966 6.85253 6.29757 11.3465 13.0634 9.0378 9.08687 numMergedOcc 0
38 mol 238 unq 4 iso 0 dist 7.67322 8.82861 6.5772 5.71717 7.39547 9.79637 7.19008 9.50847 6.17025 7.24334 numMergedOcc 0
39 mol 238 unq 5 iso 0 dist 7.49471 12.1252 6.17025 12.7938 5.43613 4.02449 10.9946 6.34909 9.0378 7.06768 numMergedOcc 0
40 mol 238 unq 6 iso 0 dist 7.49471 12.1252 6.17025 6.82305 7.24334 9.79637 12.1937 9.50847 6.5772 7.39547 numMergedOcc 0
41 mol 238 unq 7 iso 0 dist 7.19008 8.82861 6.17025 11.0772 5.43613 4.02449 11.3465 6.34909 9.0378 7.06768 numMergedOcc 0
42 mol 238 unq 8 iso 0 dist 7.19008 8.82861 6.17025 5.71717 7.24334 9.79637 7.67322 9.50847 6.5772 7.39547 numMergedOcc 0
