0 mol 25 unq 0 iso 0 dist 9.26381 10.4307 5.97432 4.32034 7.05148 6.61233 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.6783 13.653 8.19484 7.85477 5.31016 6.32189 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 8.61209 10.3681 8.37544 4.31691 6.66861 8.02931 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 5.7638 8.11218 8.37544 6.96815 6.66861 8.02931 numMergedOcc 0
4 mol 55 unq 2 iso 0 dist 8.55679 8.11218 4.92955 6.96815 6.72084 8.02931 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 7.64177 6.74975 7.34678 9.54278 8.2746 9.05781 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 7.92027 11.273 7.34678 6.71938 8.2746 9.05781 numMergedOcc 0
7 mol 62 unq 2 iso 0 dist 6.08756 5.2178 7.34678 5.31715 8.2746 9.05781 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.61468 10.4399 6.54185 14.6435 9.4486 7.15254 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 8.61468 14.263 9.68502 14.6435 9.4486 12.3113 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 8.52947 11.8293 8.42713 14.4934 7.4518 14.7862 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 8.52947 11.8293 8.42713 11.7807 9.1687 9.42916 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 8.84466 3.74136 8.42713 16.0131 7.4518 14.7862 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 8.84466 3.74136 8.42713 11.7408 9.1687 9.42916 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 8.28452 5.93237 6.20553 5.58964 5.37302 7.76807 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 8.44004 7.14947 6.20553 12.297 5.37302 7.76807 numMergedOcc 0
16 mol 128 unq 0 iso 0 dist 9.35162 11.0542 6.4416 10.2009 9.49761 8.06011 numMergedOcc 0
17 mol 128 unq 1 iso 0 dist 9.35162 11.0542 6.4416 7.34304 6.03154 5.19611 numMergedOcc 0
18 mol 128 unq 2 iso 0 dist 9.35162 5.34549 7.49024 10.2009 9.49761 6.42135 numMergedOcc 0
19 mol 128 unq 3 iso 0 dist 9.35162 5.34549 7.49024 7.34304 6.03154 4.68499 numMergedOcc 0
20 mol 131 unq 0 iso 0 dist 7.03774 5.82527 5.33314 4.20676 8.58172 4.65836 numMergedOcc 0
21 mol 131 unq 1 iso 0 dist 7.03774 5.82527 5.33314 6.9174 8.94585 7.42665 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 8.56204 5.78448 6.29631 5.82243 5.51388 7.77054 numMergedOcc 0
23 mol 173 unq 0 iso 0 dist 9.99743 9.37181 5.36078 12.1363 9.51638 11.4153 numMergedOcc 0
24 mol 181 unq 0 iso 0 dist 8.94464 5.80934 9.91705 6.15536 9.07527 6.12563 numMergedOcc 0
25 mol 233 unq 0 iso 0 dist 6.01193 6.20465 8.35521 6.3638 9.73592 11.6632 numMergedOcc 0
26 mol 233 unq 1 iso 0 dist 7.40749 5.90533 8.35521 6.52401 9.73592 11.6632 numMergedOcc 0
27 mol 247 unq 0 iso 0 dist 8.72346 10.8475 6.81743 5.81946 6.18065 7.07817 numMergedOcc 0
28 mol 247 unq 1 iso 0 dist 7.39069 6.88702 6.81743 11.7687 6.18065 7.07817 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 9.98868 8.76033 8.15795 6.60614 8.12414 8.09074 numMergedOcc 0
30 mol 268 unq 0 iso 0 dist 9.7384 7.47414 5.60058 8.90545 8.6745 9.42862 numMergedOcc 0
