0 mol 7 unq 0 iso 0 dist 5.72491 9.67164 8.0744 10.789 9.55056 14.144 7.12508 8.15894 12.8006 4.40641 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.72491 9.67164 8.0744 10.515 7.45262 8.81608 7.12508 8.15894 12.8006 7.92429 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.88043 5.99459 8.0744 12.2708 9.55056 14.144 12.8323 8.15894 12.8006 4.40641 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.88043 5.99459 8.0744 6.06176 7.45262 8.81608 12.8323 8.15894 12.8006 7.92429 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 8.80762 5.99459 11.7002 12.2708 7.57354 14.144 12.8323 8.45544 12.8006 4.40641 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 8.80762 5.99459 11.7002 6.06176 6.96586 8.81608 12.8323 8.45544 12.8006 7.92429 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 8.63486 9.2898 15.8558 11.2318 8.98797 13.5478 6.15355 5.07125 11.0852 6.43007 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.72642 7.69765 7.27912 11.7126 9.9928 16.7897 5.03039 8.4965 10.9431 13.2709 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.72642 9.42082 10.5109 11.7126 9.9928 12.9982 5.03039 8.4965 14.3113 13.2709 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 8.33077 6.93139 6.76477 8.84655 6.42785 10.1252 7.21225 6.5739 7.5573 11.4437 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.25673 7.36975 9.30534 6.01455 7.88655 7.05845 4.78563 8.612 9.94557 4.38322 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 7.25673 5.40637 6.78032 6.01455 7.88655 10.55 4.78563 8.612 9.29944 4.38322 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 7.25742 9.36259 5.34453 4.57561 7.13269 10.7736 4.48323 6.07821 10.3977 4.27525 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 4.92088 9.11204 7.79894 5.25267 5.98771 11.7594 6.42973 8.25282 9.32938 5.88866 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.83476 7.2793 6.38897 13.1933 7.94153 11.0523 13.6744 7.04815 8.39342 5.93479 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.83476 7.2793 6.38897 13.1933 7.94153 11.0523 15.0914 6.07389 11.3617 5.86306 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 9.83476 9.51091 8.93258 13.1933 7.94153 14.1797 13.6744 7.04815 10.5048 5.93479 numMergedOcc 0
17 mol 186 unq 3 iso 0 dist 9.83476 9.51091 8.93258 13.1933 7.94153 14.1797 15.0914 6.07389 13.7777 5.86306 numMergedOcc 0
18 mol 186 unq 4 iso 0 dist 9.83476 7.85184 11.924 13.1933 7.94153 17.0388 13.6744 7.04815 18.2507 5.93479 numMergedOcc 0
19 mol 186 unq 5 iso 0 dist 9.83476 7.85184 11.924 13.1933 7.94153 17.0388 15.0914 6.07389 17.1125 5.86306 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 6.60567 7.41662 9.48862 13.6975 9.79691 18.9952 5.41635 6.34234 11.6534 10.5776 numMergedOcc 0
21 mol 195 unq 1 iso 0 dist 6.60567 7.41662 9.48862 13.6975 9.79691 18.9952 11.9954 7.87972 16.4813 4.18074 numMergedOcc 0
22 mol 195 unq 2 iso 0 dist 7.62942 9.03441 8.89297 6.08211 9.79691 12.3988 6.04871 6.34234 11.3524 10.5776 numMergedOcc 0
23 mol 195 unq 3 iso 0 dist 7.62942 9.03441 8.89297 6.08211 9.79691 12.3988 8.04534 7.87972 12.8025 4.18074 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 7.63018 8.63693 6.75621 10.9823 6.4829 11.516 11.3763 9.14831 11.1983 15.1464 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 9.18895 9.7982 6.47351 9.60485 7.95883 10.1761 4.81762 9.22269 10.0412 5.65395 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 8.38865 5.23634 7.3164 9.60993 9.20589 12.2075 4.1511 5.28771 6.09335 9.08701 numMergedOcc 0
27 mol 227 unq 1 iso 0 dist 8.38865 5.23634 7.3164 13.3557 7.89801 11.5426 4.1511 5.28771 6.09335 12.0749 numMergedOcc 0
28 mol 227 unq 2 iso 0 dist 5.4694 6.91318 7.3164 5.34702 9.20589 12.2075 4.69247 5.28771 6.09335 9.08701 numMergedOcc 0
29 mol 227 unq 3 iso 0 dist 5.4694 6.91318 7.3164 8.8709 7.89801 11.5426 4.69247 5.28771 6.09335 12.0749 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 5.52379 9.07475 6.50998 11.6239 7.61203 11.316 4.48415 6.53286 11.9473 9.75095 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 5.52379 9.07475 6.50998 13.9614 9.47845 14.1582 4.48415 6.53286 11.9473 11.7938 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 5.52379 9.07475 6.50998 12.3042 6.92409 10.2916 4.48415 6.53286 11.9473 11.7709 numMergedOcc 0
33 mol 238 unq 3 iso 0 dist 5.52379 9.07475 6.50998 5.54325 6.89694 8.82776 4.48415 6.53286 11.9473 6.12722 numMergedOcc 0
34 mol 238 unq 4 iso 0 dist 5.52379 6.99888 5.63944 11.6239 7.61203 9.99105 4.48415 6.53286 9.51483 9.75095 numMergedOcc 0
35 mol 238 unq 5 iso 0 dist 5.52379 6.99888 5.63944 13.9614 9.47845 13.7042 4.48415 6.53286 9.51483 11.7938 numMergedOcc 0
36 mol 238 unq 6 iso 0 dist 5.52379 6.99888 5.63944 12.3042 6.92409 10.8123 4.48415 6.53286 9.51483 11.7709 numMergedOcc 0
37 mol 238 unq 7 iso 0 dist 5.52379 6.99888 5.63944 5.54325 6.89694 5.43613 4.48415 6.53286 9.51483 6.12722 numMergedOcc 0
38 mol 264 unq 0 iso 0 dist 6.04162 9.19754 5.82131 8.16326 9.42738 13.8261 11.4167 7.14086 9.78237 9.04569 numMergedOcc 0
39 mol 264 unq 1 iso 0 dist 6.14323 8.29262 5.82131 12.3807 9.42738 13.8261 13.2035 7.14086 9.78237 9.04569 numMergedOcc 0
