0 mol 24 unq 0 iso 0 dist 8.13365 10.5449 6.86014 17.544 10.0952 8.86116 16.7488 12.5077 6.44287 8.38394 21.7352 16.0162 11.6226 8.09311 6.17155 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.13365 10.5449 6.86014 17.544 10.0952 8.86116 16.7488 12.5077 6.44287 8.38394 22.9237 16.8554 13.1949 9.05357 10.3122 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 7.59073 4.53858 5.73196 11.7649 10.1164 7.66905 14.1017 15.309 10.7229 7.95579 7.93044 11.2056 5.59906 7.7068 6.36397 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 7.59073 4.53858 5.73196 11.7649 10.1164 7.66905 10.8225 11.2656 6.9948 6.19965 7.93044 11.2056 5.59906 7.7068 4.41789 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 22.5988 16.9836 16.6055 9.03572 22.0605 15.6447 15.6249 8.27883 4.99174 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 22.5988 16.9836 16.6055 9.03572 20.7364 14.0772 12.4896 5.75428 4.46005 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 22.5988 16.9836 16.6055 9.03572 18.0946 14.1515 14.2178 8.57395 8.28518 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 22.5988 16.9836 16.6055 9.03572 14.7495 10.3132 8.78079 9.85409 15.917 numMergedOcc 0
8 mol 95 unq 4 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 24.1089 16.9811 13.8105 8.83255 22.0605 15.6447 15.6249 8.27883 8.67311 numMergedOcc 0
9 mol 95 unq 5 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 24.1089 16.9811 13.8105 8.83255 20.7364 14.0772 12.4896 5.75428 3.94293 numMergedOcc 0
10 mol 95 unq 6 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 24.1089 16.9811 13.8105 8.83255 18.0946 14.1515 14.2178 8.57395 9.22202 numMergedOcc 0
11 mol 95 unq 7 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 24.1089 16.9811 13.8105 8.83255 14.7495 10.3132 8.78079 9.85409 13.7484 numMergedOcc 0
12 mol 95 unq 8 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 24.4415 16.9836 16.6055 9.03572 23.3468 15.6447 15.6249 8.27883 4.99174 numMergedOcc 0
13 mol 95 unq 9 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 24.4415 16.9836 16.6055 9.03572 20.8768 14.0772 12.4896 5.75428 4.46005 numMergedOcc 0
14 mol 95 unq 10 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 24.4415 16.9836 16.6055 9.03572 20.382 14.1515 14.2178 8.57395 8.28518 numMergedOcc 0
15 mol 95 unq 11 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 24.4415 16.9836 16.6055 9.03572 12.8891 10.3132 8.78079 9.85409 15.917 numMergedOcc 0
16 mol 95 unq 12 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 22.951 16.9811 13.8105 8.83255 23.3468 15.6447 15.6249 8.27883 8.67311 numMergedOcc 0
17 mol 95 unq 13 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 22.951 16.9811 13.8105 8.83255 20.8768 14.0772 12.4896 5.75428 3.94293 numMergedOcc 0
18 mol 95 unq 14 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 22.951 16.9811 13.8105 8.83255 20.382 14.1515 14.2178 8.57395 9.22202 numMergedOcc 0
19 mol 95 unq 15 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 22.951 16.9811 13.8105 8.83255 12.8891 10.3132 8.78079 9.85409 13.7484 numMergedOcc 0
20 mol 115 unq 0 iso 0 dist 5.22628 10.0419 9.33865 11.2519 7.69052 5.83991 17.2604 13.8473 10.8507 7.30858 14.524 13.4105 4.48636 7.69765 10.3209 numMergedOcc 0
21 mol 115 unq 1 iso 0 dist 5.22628 10.0419 9.33865 11.2519 7.69052 5.83991 17.2604 13.8473 10.8507 7.30858 3.82475 6.39384 6.63111 9.42082 15.3161 numMergedOcc 0
22 mol 115 unq 2 iso 0 dist 5.22628 10.0419 9.33865 11.2519 7.69052 5.83991 6.8104 6.11741 8.02349 7.88312 14.524 13.4105 4.48636 7.69765 11.835 numMergedOcc 0
23 mol 115 unq 3 iso 0 dist 5.22628 10.0419 9.33865 11.2519 7.69052 5.83991 6.8104 6.11741 8.02349 7.88312 3.82475 6.39384 6.63111 9.42082 6.07067 numMergedOcc 0
24 mol 115 unq 4 iso 0 dist 5.22628 6.8104 6.11741 11.2519 7.69052 7.88312 17.2604 13.8473 11.5723 7.30858 14.524 13.4105 11.835 7.69765 10.3209 numMergedOcc 0
25 mol 115 unq 5 iso 0 dist 5.22628 6.8104 6.11741 11.2519 7.69052 7.88312 17.2604 13.8473 11.5723 7.30858 3.82475 6.39384 6.07067 9.42082 15.3161 numMergedOcc 0
26 mol 115 unq 6 iso 0 dist 5.22628 6.8104 6.11741 11.2519 7.69052 7.88312 10.0419 9.33865 8.02349 5.83991 14.524 13.4105 11.835 7.69765 4.48636 numMergedOcc 0
27 mol 115 unq 7 iso 0 dist 5.22628 6.8104 6.11741 11.2519 7.69052 7.88312 10.0419 9.33865 8.02349 5.83991 3.82475 6.39384 6.07067 9.42082 6.63111 numMergedOcc 0
28 mol 117 unq 0 iso 0 dist 9.60425 5.17524 9.84395 12.6233 13.1058 7.90328 10.7342 16.5575 7.22206 7.83136 11.119 16.804 7.20875 8.84018 3.77029 numMergedOcc 0
29 mol 117 unq 1 iso 0 dist 9.60425 5.17524 9.84395 12.6233 13.1058 7.90328 14.3217 17.163 9.3584 7.0603 11.119 16.804 7.20875 8.84018 5.21535 numMergedOcc 0
30 mol 133 unq 0 iso 0 dist 6.53153 5.78974 9.91388 8.29673 6.761 7.24514 9.35671 10.0372 6.65743 8.22656 10.2739 12.4934 5.03174 8.26547 4.88025 numMergedOcc 0
31 mol 133 unq 1 iso 0 dist 6.29975 5.78974 9.52634 8.29673 7.6656 7.24514 9.35671 13.4163 6.65743 8.22656 10.2739 13.5471 5.03174 8.26547 4.88025 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 9.61379 9.57016 8.95269 11.7326 4.70378 6.57273 11.8576 9.99123 5.0744 6.60589 16.3208 13.2325 7.05804 8.79428 5.76843 numMergedOcc 0
33 mol 224 unq 1 iso 0 dist 9.61379 9.57016 8.95269 14.3448 11.5372 5.78342 11.8576 9.99123 5.0744 9.16166 16.3208 13.2325 7.05804 6.8692 5.76843 numMergedOcc 0
34 mol 224 unq 2 iso 0 dist 9.61379 9.57016 8.95269 14.3448 11.5372 5.78342 14.6141 14.0676 5.60236 5.81334 16.3208 13.2325 7.05804 6.8692 4.54188 numMergedOcc 0
35 mol 229 unq 0 iso 0 dist 8.52933 10.568 9.06952 13.4598 6.84129 7.03423 16.0121 13.2905 5.57838 8.22528 15.0835 11.9869 7.22525 7.27993 5.70473 numMergedOcc 0
36 mol 234 unq 0 iso 0 dist 6.15754 12.4455 6.56247 8.9413 5.88703 9.45496 14.0876 9.36357 7.82322 6.7625 14.075 11.6391 12.4252 7.81215 5.75498 numMergedOcc 0
37 mol 234 unq 1 iso 0 dist 6.15754 14.0876 9.36357 8.9413 5.88703 6.7625 12.4455 6.56247 7.82322 9.45496 14.075 11.6391 5.75498 7.81215 12.4252 numMergedOcc 0
38 mol 234 unq 2 iso 0 dist 6.6281 10.0624 6.56247 11.5469 5.88703 9.45496 13.9869 9.36357 7.82322 6.7625 14.9333 11.6391 12.4252 7.81215 5.75498 numMergedOcc 0
39 mol 234 unq 3 iso 0 dist 6.6281 13.9869 9.36357 11.5469 5.88703 6.7625 10.0624 6.56247 7.82322 9.45496 14.9333 11.6391 5.75498 7.81215 12.4252 numMergedOcc 0
40 mol 259 unq 0 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 6.08432 9.95973 4.86771 7.84554 10.4532 12.8229 7.20604 9.63573 5.05362 numMergedOcc 0
41 mol 259 unq 1 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 6.08432 9.95973 4.86771 7.84554 5.13757 9.07743 8.8603 7.66153 5.8801 numMergedOcc 0
42 mol 259 unq 2 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 10.3156 10.3935 6.96053 7.46176 10.4532 12.8229 7.20604 9.63573 5.21606 numMergedOcc 0
43 mol 259 unq 3 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 10.3156 10.3935 6.96053 7.46176 5.13757 9.07743 8.8603 7.66153 11.8896 numMergedOcc 0
44 mol 259 unq 4 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 9.55719 12.6839 10.4881 9.18903 10.4532 12.8229 7.20604 9.63573 7.46841 numMergedOcc 0
45 mol 259 unq 5 iso 0 dist 5.29682 5.56656 8.13497 6.20344 4.69778 7.88519 9.55719 12.6839 10.4881 9.18903 5.13757 9.07743 8.8603 7.66153 5.81576 numMergedOcc 0
46 mol 259 unq 6 iso 0 dist 6.20344 5.56656 7.88519 5.29682 4.69778 8.13497 5.48552 10.5767 10.582 8.53687 5.13757 7.66153 8.8603 9.07743 6.73882 numMergedOcc 0
