0 mol 25 unq 0 iso 0 dist 8.40051 13.0772 6.90155 13.591 9.48085 13.7717 8.78181 6.08585 12.7162 6.53269 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.40051 13.0772 6.90155 13.591 9.48085 13.7717 10.9235 9.15781 15.9412 9.81524 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.6396 13.3963 6.6492 5.23233 6.55597 8.89681 8.78181 5.77929 11.4352 9.16515 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 8.6396 13.3963 6.6492 10.4709 7.07751 5.5511 8.78181 5.77929 11.4352 9.82987 numMergedOcc 0
4 mol 25 unq 4 iso 0 dist 8.6396 13.3963 6.6492 13.591 9.49421 11.7199 8.78181 5.77929 11.4352 6.53269 numMergedOcc 0
5 mol 25 unq 5 iso 0 dist 8.6396 13.3963 6.6492 13.591 9.49421 11.7199 10.9235 6.68639 12.7621 9.81524 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.18305 11.4574 8.73253 4.21749 8.68662 10.9746 9.54477 6.56633 6.48232 8.96616 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.18305 11.4574 8.73253 5.65986 7.4369 7.8972 9.54477 6.56633 6.48232 6.14542 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.58841 5.25697 4.79949 16.3337 9.85905 11.0792 14.8689 6.45686 10.489 7.46095 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.58841 10.7962 7.27693 16.3337 9.85905 6.48293 14.8689 6.45686 9.75201 7.46095 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.44385 9.79485 7.99857 5.92411 6.99446 6.29394 9.34823 10.8661 14.7366 8.67537 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 5.63005 9.79485 8.56342 5.92411 7.64052 6.29394 9.34823 12.0175 14.7366 8.67537 numMergedOcc 0
12 mol 119 unq 2 iso 0 dist 5.63005 6.81112 6.37542 5.92411 7.64052 9.64502 9.34823 12.0175 15.9094 8.67537 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.92932 8.2282 8.20836 3.76211 7.21868 4.935 12.1527 4.57832 9.30061 9.0176 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 9.60369 4.02705 7.36779 4.63732 9.66543 4.935 11.9876 7.1797 9.30061 9.0176 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 9.55556 4.02705 8.20836 4.63732 7.21868 4.935 11.9876 4.57832 9.30061 9.0176 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 6.23399 9.97577 7.72144 5.18463 8.33439 14.4682 5.60184 7.51976 10.1459 8.71789 numMergedOcc 0
17 mol 154 unq 1 iso 0 dist 6.23399 9.97577 7.72144 5.18463 8.33439 14.4682 7.08477 7.23684 14.0292 5.2693 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.03995 9.52773 9.83476 11.8169 7.2793 6.38897 12.1826 10.5063 4.5271 6.88127 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 8.03995 11.8884 6.258 11.8169 7.2793 8.88593 12.1826 10.5063 14.8067 6.88127 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 8.6537 7.78418 8.92743 3.72432 7.27993 6.93188 9.38362 6.65022 13.9637 9.37336 numMergedOcc 0
21 mol 229 unq 1 iso 0 dist 5.57702 7.78418 5.77318 3.72432 6.95201 6.93188 9.38362 10.2411 13.9637 9.37336 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 7.86368 6.83465 7.5366 9.8663 7.81215 11.0592 14.6064 10.0059 16.6111 7.77911 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.65265 14.2269 7.4099 18.3627 9.30212 5.85225 18.4464 9.5468 11.1385 7.77765 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 9.65265 14.2269 7.4099 11.4981 6.4611 13.4431 18.4464 9.5468 11.1385 9.65868 numMergedOcc 0
25 mol 274 unq 2 iso 0 dist 9.65265 14.2269 7.4099 11.4981 6.4611 13.4431 14.3742 6.70925 10.9469 8.60027 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 9.77689 9.41779 6.57903 17.8399 9.57499 14.6871 15.2129 6.28695 7.85414 9.26157 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 8.51931 12.4389 6.57903 6.17642 9.57499 14.6871 10.5 6.28695 7.85414 9.26157 numMergedOcc 0
