0 mol 20 unq 0 iso 0 dist 9.78431 10.6755 5.83917 12.7529 5.28474 5.9809 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.87762 15.2801 7.79336 20.2039 13.1232 8.38156 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.87762 15.2801 7.79336 8.21762 3.39994 7.08559 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 8.21762 15.2801 7.08559 20.2039 12.7516 8.38156 numMergedOcc 0
4 mol 34 unq 3 iso 0 dist 8.21762 15.2801 7.08559 8.87762 3.39994 7.79336 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 7.63443 6.1599 7.60018 5.40287 3.6461 7.03126 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 5.40287 6.1599 7.03126 7.63443 3.6461 7.60018 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 5.14123 9.82767 8.35444 15.8508 13.6068 6.52887 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 5.35145 8.6915 8.96498 15.7691 15.3956 7.5228 numMergedOcc 0
9 mol 135 unq 0 iso 0 dist 8.55869 8.30838 9.09753 6.65965 3.61409 7.6337 numMergedOcc 0
10 mol 135 unq 1 iso 0 dist 6.65965 8.30838 7.6337 8.55869 3.61409 9.09753 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 6.20862 6.299 8.91356 11.8187 9.9109 9.57455 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 7.27888 13.7014 8.91356 13.3277 9.9109 9.57455 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 7.86214 6.99665 6.01775 13.5679 8.23358 8.24424 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 7.86214 6.99665 6.01775 10.934 6.91967 7.0942 numMergedOcc 0
15 mol 233 unq 2 iso 0 dist 5.29501 4.43794 6.01775 11.2143 8.23358 8.24424 numMergedOcc 0
16 mol 233 unq 3 iso 0 dist 5.29501 4.43794 6.01775 10.1504 6.91967 7.0942 numMergedOcc 0
17 mol 233 unq 4 iso 0 dist 8.81206 11.2489 6.01775 16.7991 8.23358 8.24424 numMergedOcc 0
18 mol 233 unq 5 iso 0 dist 8.81206 11.2489 6.01775 15.4586 6.91967 7.0942 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 4.37501 5.04225 8.27411 11.866 15.1017 6.96257 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 9.93282 11.4659 6.23661 16.5308 8.0048 8.84648 numMergedOcc 0
21 mol 267 unq 0 iso 0 dist 8.63426 10.8336 6.32877 14.5905 6.14857 9.48115 numMergedOcc 0
22 mol 267 unq 1 iso 0 dist 8.63426 10.8336 6.32877 18.6013 12.5387 8.38545 numMergedOcc 0
23 mol 267 unq 2 iso 0 dist 8.63426 10.8336 6.32877 14.5477 11.3792 5.08174 numMergedOcc 0
24 mol 267 unq 3 iso 0 dist 8.63426 10.8336 6.32877 16.7254 11.7355 6.10838 numMergedOcc 0
25 mol 267 unq 4 iso 0 dist 8.04091 7.37981 6.32877 13.2996 6.14857 9.48115 numMergedOcc 0
26 mol 267 unq 5 iso 0 dist 8.04091 7.37981 6.32877 12.2265 12.5387 8.38545 numMergedOcc 0
27 mol 267 unq 6 iso 0 dist 8.04091 7.37981 6.32877 10.6588 11.3792 5.08174 numMergedOcc 0
28 mol 267 unq 7 iso 0 dist 8.04091 7.37981 6.32877 12.5562 11.7355 6.10838 numMergedOcc 0
29 mol 270 unq 0 iso 0 dist 9.6012 6.83592 9.51462 12.2684 6.94419 8.12971 numMergedOcc 0
