0 mol 59 unq 0 iso 0 dist 4.74574 4.80894 6.23509 6.48339 4.74563 7.17026 5.44752 9.45821 6.08003 8.64015 numMergedOcc 0
1 mol 119 unq 0 iso 0 dist 6.66313 4.85157 4.55071 14.4475 10.7475 9.6121 10.6846 10.1864 6.9194 7.77116 numMergedOcc 0
2 mol 119 unq 1 iso 0 dist 6.3646 5.74561 4.55071 13.2368 10.7475 9.6121 12.3674 10.1864 6.9194 7.77116 numMergedOcc 0
3 mol 171 unq 0 iso 0 dist 6.80203 4.91613 9.68512 11.6226 11.6193 8.999 6.70239 11.9039 4.00127 9.11712 numMergedOcc 0
4 mol 171 unq 1 iso 0 dist 8.00826 4.61696 9.68512 5.94881 11.6193 8.999 7.24557 11.9039 4.00127 9.11712 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 8.19926 14.4294 8.92135 17.1697 9.28201 8.57801 21.0157 14.8324 6.89047 9.56197 numMergedOcc 0
6 mol 186 unq 1 iso 0 dist 8.19926 14.4294 8.92135 17.1697 9.28201 8.57801 11.8143 5.90765 3.90244 7.24795 numMergedOcc 0
7 mol 186 unq 2 iso 0 dist 8.19926 14.4294 8.92135 17.1697 9.28201 8.57801 25.0905 17.3863 12.6058 8.64409 numMergedOcc 0
8 mol 186 unq 3 iso 0 dist 8.19926 14.4294 8.92135 17.1697 9.28201 8.57801 20.2839 13.011 7.21555 7.60202 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 9.3032 10.739 4.45769 8.26119 7.82899 5.53324 5.69334 9.52922 10.0756 6.26839 numMergedOcc 0
10 mol 194 unq 1 iso 0 dist 9.3032 10.739 4.45769 8.26119 7.82899 5.53324 13.2099 11.2599 10.2793 8.12346 numMergedOcc 0
11 mol 194 unq 2 iso 0 dist 9.3032 10.739 4.45769 8.26119 7.82899 5.53324 16.2258 14.7152 10.463 8.83356 numMergedOcc 0
12 mol 194 unq 3 iso 0 dist 9.3032 10.739 4.45769 8.26119 7.82899 5.53324 13.4175 14.7929 12.8494 8.2654 numMergedOcc 0
13 mol 194 unq 4 iso 0 dist 8.10451 5.22745 4.45769 9.10338 7.82899 5.53324 13.5654 9.52922 10.0756 6.26839 numMergedOcc 0
14 mol 194 unq 5 iso 0 dist 8.10451 5.22745 4.45769 9.10338 7.82899 5.53324 10.2888 11.2599 10.2793 8.12346 numMergedOcc 0
15 mol 194 unq 6 iso 0 dist 8.10451 5.22745 4.45769 9.10338 7.82899 5.53324 11.1617 14.7152 10.463 8.83356 numMergedOcc 0
16 mol 194 unq 7 iso 0 dist 8.10451 5.22745 4.45769 9.10338 7.82899 5.53324 13.9257 14.7929 12.8494 8.2654 numMergedOcc 0
17 mol 194 unq 8 iso 0 dist 6.6747 5.22745 5.89939 9.10338 10.0237 5.53324 13.5654 11.7672 10.0756 6.26839 numMergedOcc 0
18 mol 194 unq 9 iso 0 dist 6.6747 5.22745 5.89939 9.10338 10.0237 5.53324 10.2888 11.0369 10.2793 8.12346 numMergedOcc 0
19 mol 194 unq 10 iso 0 dist 6.6747 5.22745 5.89939 9.10338 10.0237 5.53324 11.1617 15.9798 10.463 8.83356 numMergedOcc 0
20 mol 194 unq 11 iso 0 dist 6.6747 5.22745 5.89939 9.10338 10.0237 5.53324 13.9257 15.7836 12.8494 8.2654 numMergedOcc 0
21 mol 194 unq 12 iso 0 dist 6.28412 12.1687 5.89939 15.9115 10.0237 5.53324 16.0085 11.7672 10.0756 6.26839 numMergedOcc 0
22 mol 194 unq 13 iso 0 dist 6.28412 12.1687 5.89939 15.9115 10.0237 5.53324 15.0245 11.0369 10.2793 8.12346 numMergedOcc 0
23 mol 194 unq 14 iso 0 dist 6.28412 12.1687 5.89939 15.9115 10.0237 5.53324 22.1775 15.9798 10.463 8.83356 numMergedOcc 0
24 mol 194 unq 15 iso 0 dist 6.28412 12.1687 5.89939 15.9115 10.0237 5.53324 20.6352 15.7836 12.8494 8.2654 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 9.02494 6.38826 8.74463 15.6149 13.9338 9.87668 22.9681 22.7648 17.3148 8.87609 numMergedOcc 0
26 mol 252 unq 0 iso 0 dist 4.15692 8.3996 9.81261 17.0584 19.1465 9.39658 11.7791 14.2216 5.6214 6.11473 numMergedOcc 0
27 mol 252 unq 1 iso 0 dist 4.15692 8.3996 9.81261 14.1515 14.8966 5.9974 11.7791 14.2216 5.6214 6.53679 numMergedOcc 0
28 mol 252 unq 2 iso 0 dist 4.15692 8.3996 9.81261 14.1515 14.8966 5.9974 11.7432 12.9602 7.40852 7.50201 numMergedOcc 0
29 mol 264 unq 0 iso 0 dist 8.26228 4.66338 9.87744 8.43465 8.89888 6.02757 9.51384 14.7806 5.71153 7.52281 numMergedOcc 0
30 mol 264 unq 1 iso 0 dist 8.26228 4.66338 9.87744 8.43465 8.89888 6.02757 10.2047 10.4401 6.56539 6.42588 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 8.71708 4.13716 7.56691 10.8109 5.78276 7.59696 11.9557 5.35705 10.0918 7.67245 numMergedOcc 0
32 mol 278 unq 1 iso 0 dist 8.71708 4.13716 7.56691 10.8109 5.78276 7.59696 7.70278 6.64378 6.48173 9.12395 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 9.98334 8.66839 4.98693 12.2565 7.93548 5.8304 6.81439 10.6394 6.5644 8.29305 numMergedOcc 0
34 mol 279 unq 1 iso 0 dist 9.98334 8.66839 4.98693 12.2565 7.93548 5.8304 12.9312 13.2372 9.40912 6.43341 numMergedOcc 0
