0 mol 8 unq 0 iso 0 dist 4.92734 7.35767 8.96553 7.0822 8.33604 8.27181 7.97177 8.53529 4.36226 11.4716 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.23095 10.747 7.31767 7.40735 7.685 8.43188 12.1434 8.6653 5.64303 12.9735 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.23095 11.5983 6.03987 7.40735 7.685 10.3635 12.1434 8.6653 5.82503 12.9735 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 5.26018 12.8491 9.80098 9.26324 7.18176 5.93337 5.09324 6.31696 11.6682 6.29814 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 5.26018 10.3287 7.34143 9.26324 7.18176 4.5482 5.09324 6.31696 6.66056 6.29814 numMergedOcc 0
5 mol 52 unq 2 iso 0 dist 7.1203 5.92851 9.80098 6.22409 7.18176 5.93337 10.4823 6.31696 11.6682 6.29814 numMergedOcc 0
6 mol 52 unq 3 iso 0 dist 7.1203 6.03647 7.34143 6.22409 7.18176 4.5482 10.4823 6.31696 6.66056 6.29814 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 6.68311 8.1124 8.8178 13.1473 6.77912 12.0644 15.1138 9.27838 15.434 4.67641 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 6.68311 15.0607 9.96708 13.1473 6.77912 7.11552 15.1138 9.27838 11.6378 4.67641 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 8.92577 6.89293 6.45675 7.38658 8.72704 7.2495 5.48646 7.38135 7.11701 11.0949 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 8.92577 12.0555 7.47343 7.38658 8.72704 10.1589 5.48646 7.38135 11.2312 11.0949 numMergedOcc 0
11 mol 100 unq 2 iso 0 dist 8.92577 12.7188 8.86688 7.38658 8.72704 15.9331 5.48646 7.38135 7.79768 11.0949 numMergedOcc 0
12 mol 100 unq 3 iso 0 dist 9.56324 15.1093 6.45675 15.7025 8.72704 7.2495 11.0196 7.38135 7.11701 11.0949 numMergedOcc 0
13 mol 100 unq 4 iso 0 dist 9.56324 16.8752 7.47343 15.7025 8.72704 10.1589 11.0196 7.38135 11.2312 11.0949 numMergedOcc 0
14 mol 100 unq 5 iso 0 dist 9.56324 13.0353 8.86688 15.7025 8.72704 15.9331 11.0196 7.38135 7.79768 11.0949 numMergedOcc 0
15 mol 100 unq 6 iso 0 dist 5.70279 5.92158 7.47343 11.8754 7.75343 15.209 10.838 8.30845 12.2861 10.0891 numMergedOcc 0
16 mol 100 unq 7 iso 0 dist 5.70279 5.92158 7.47343 11.8754 7.75343 15.209 11.4018 8.76378 15.5385 4.44538 numMergedOcc 0
17 mol 100 unq 8 iso 0 dist 5.70279 5.85449 6.65086 11.8754 7.75343 10.9608 10.838 8.30845 5.80144 10.0891 numMergedOcc 0
18 mol 100 unq 9 iso 0 dist 5.70279 5.85449 6.65086 11.8754 7.75343 10.9608 11.4018 8.76378 12.3577 4.44538 numMergedOcc 0
19 mol 100 unq 10 iso 0 dist 5.70279 7.68675 6.56369 11.8754 7.75343 5.69137 10.838 8.30845 10.0456 10.0891 numMergedOcc 0
20 mol 100 unq 11 iso 0 dist 5.70279 7.68675 6.56369 11.8754 7.75343 5.69137 11.4018 8.76378 4.97045 4.44538 numMergedOcc 0
21 mol 100 unq 12 iso 0 dist 5.70279 9.53223 9.30209 11.8754 7.75343 9.21622 10.838 8.30845 6.70236 10.0891 numMergedOcc 0
22 mol 100 unq 13 iso 0 dist 5.70279 9.53223 9.30209 11.8754 7.75343 9.21622 11.4018 8.76378 10.7791 4.44538 numMergedOcc 0
23 mol 109 unq 0 iso 0 dist 8.84523 14.7654 8.69985 5.38332 5.87358 9.46098 10.8869 7.80523 7.74599 6.89298 numMergedOcc 0
24 mol 131 unq 0 iso 0 dist 8.99949 11.3502 6.85062 9.45501 6.91348 6.19596 10.5805 8.70296 14.2045 9.93183 numMergedOcc 0
25 mol 131 unq 1 iso 0 dist 8.99949 11.3502 6.85062 9.45501 6.91348 6.19596 8.98062 9.25558 5.09131 5.90177 numMergedOcc 0
26 mol 131 unq 2 iso 0 dist 8.99949 11.3502 6.85062 9.03202 9.51418 6.6499 10.5805 8.70296 14.2045 16.5048 numMergedOcc 0
27 mol 131 unq 3 iso 0 dist 8.99949 11.3502 6.85062 9.03202 9.51418 6.6499 8.98062 9.25558 5.09131 5.70899 numMergedOcc 0
28 mol 134 unq 0 iso 0 dist 5.57904 7.41837 6.54501 7.26771 8.6355 10.1448 12.4426 7.80532 7.41674 14.1488 numMergedOcc 0
29 mol 134 unq 1 iso 0 dist 5.57904 6.50005 6.49416 7.26771 8.6355 5.41704 12.4426 7.80532 9.87376 14.1488 numMergedOcc 0
30 mol 155 unq 0 iso 0 dist 5.68636 7.92939 6.43582 7.441 9.38946 12.8482 5.52764 7.92304 5.50031 9.50478 numMergedOcc 0
31 mol 155 unq 1 iso 0 dist 5.68636 7.92939 6.43582 6.79302 7.36102 8.27726 5.52764 7.92304 5.50031 5.50045 numMergedOcc 0
32 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 11.9162 9.36805 6.29785 5.02458 9.44367 5.4555 10.143 numMergedOcc 0
33 mol 156 unq 1 iso 0 dist 9.19499 5.66289 7.44554 11.9162 9.36805 6.29785 15.8724 9.47433 11.9952 10.0003 numMergedOcc 0
34 mol 209 unq 0 iso 0 dist 6.14896 9.80484 7.56373 4.86181 7.95911 7.19056 5.78532 6.85935 6.552 5.50596 numMergedOcc 0
35 mol 209 unq 1 iso 0 dist 9.12289 11.2544 7.56373 7.37293 7.95911 7.19056 4.84945 6.85935 6.552 5.50596 numMergedOcc 0
36 mol 222 unq 0 iso 0 dist 5.47561 10.6375 8.01589 11.3364 6.82208 4.8892 10.3328 7.67576 10.3151 7.39748 numMergedOcc 0
37 mol 222 unq 1 iso 0 dist 5.47561 10.6375 8.01589 11.3364 6.82208 4.8892 15.0445 9.82371 8.52017 5.08928 numMergedOcc 0
38 mol 222 unq 2 iso 0 dist 5.47561 5.39098 7.7699 11.3364 6.82208 11.0074 10.3328 7.67576 7.81022 7.39748 numMergedOcc 0
39 mol 222 unq 3 iso 0 dist 5.47561 5.39098 7.7699 11.3364 6.82208 11.0074 15.0445 9.82371 15.7504 5.08928 numMergedOcc 0
40 mol 222 unq 4 iso 0 dist 5.47561 5.60111 7.21333 11.3364 6.82208 12.2813 10.3328 7.67576 7.75656 7.39748 numMergedOcc 0
41 mol 222 unq 5 iso 0 dist 5.47561 5.60111 7.21333 11.3364 6.82208 12.2813 15.0445 9.82371 16.0949 5.08928 numMergedOcc 0
42 mol 278 unq 0 iso 0 dist 8.83775 4.66992 8.44326 9.59763 6.35287 6.07447 4.36832 8.00673 4.97614 7.83538 numMergedOcc 0
