0 mol 29 unq 0 iso 0 dist 5.36278 6.69806 8.53135 4.10356 7.28761 7.27473 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 7.50258 5.82508 8.53135 10.3687 7.28761 7.27473 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.84944 11.3412 7.67459 10.9311 7.32236 11.1757 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.21995 5.88097 7.67459 6.43999 7.32236 11.1757 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.43409 5.81148 8.0757 8.07459 8.12708 12.7184 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 7.43409 10.7288 9.8958 8.07459 8.12708 12.7555 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.48556 15.0455 8.08507 10.5152 8.61566 10.1704 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 7.48556 15.0455 8.08507 9.39279 5.02942 6.7679 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.65031 12.1354 9.27341 10.9552 9.17101 12.2127 numMergedOcc 0
9 mol 152 unq 1 iso 0 dist 8.51844 6.67687 9.27341 6.05258 9.17101 12.2127 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 9.96635 17.5374 8.95432 10.1247 8.79758 11.8233 numMergedOcc 0
11 mol 170 unq 0 iso 0 dist 4.44987 11.8056 9.15159 5.80243 7.45761 12.8766 numMergedOcc 0
12 mol 174 unq 0 iso 0 dist 8.16228 5.38744 9.56869 14.5347 9.79225 16.7408 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.72718 11.315 9.60838 11.4764 8.11956 11.4066 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 6.2016 6.16078 5.83093 7.71442 5.90008 8.82579 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 8.05949 11.5037 8.50367 11.533 6.93215 7.54885 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 8.05949 15.7959 8.94889 11.533 6.93215 10.4785 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 7.96226 3.92881 7.35677 5.17472 8.96074 4.38027 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 8.82663 11.6942 7.35677 9.33375 8.96074 4.38027 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.26312 13.8702 7.10828 7.80147 9.90442 13.6835 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 7.58554 8.46058 7.10828 10.7751 9.90442 13.6835 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 9.54511 9.66767 5.73448 9.92619 9.56058 12.4202 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 7.58385 6.29331 8.25759 10.8524 9.66703 14.9805 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 8.54984 6.0405 8.30313 10.7231 9.82919 14.1269 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 5.15923 11.7624 9.30394 13.3487 9.82863 4.70335 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 5.15923 5.58788 5.84467 13.3487 9.82863 9.38112 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 5.15923 11.7624 9.30394 13.3487 9.82863 4.70335 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 5.15923 5.58788 5.84467 13.3487 9.82863 9.38112 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 5.15923 11.7624 9.30394 13.3487 9.82863 4.70335 numMergedOcc 0
29 mol 289 unq 1 iso 0 dist 5.15923 5.58788 5.84467 13.3487 9.82863 9.38112 numMergedOcc 0
