0 mol 10 unq 0 iso 0 dist 5.99743 6.47443 5.83346 8.98746 7.60549 4.68389 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 6.67704 8.47386 5.4499 6.93709 3.28726 5.27648 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.71284 5.55479 10.4994 9.0665 6.59793 7.20258 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.71284 5.55479 10.4994 9.36493 7.83556 11.2499 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 8.71284 5.55479 10.4994 7.07773 9.10687 6.48477 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 5.81645 9.99671 11.0089 9.80946 12.6428 5.33571 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 6.75026 9.99671 6.6172 9.80946 8.28169 5.33571 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.93628 7.39468 5.61827 7.05964 7.17582 4.91531 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 9.93628 5.55714 8.4772 7.05964 7.17582 4.38297 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 9.93628 9.85287 8.04036 7.05964 7.17582 3.63523 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 7.80375 9.47628 15.2594 9.93968 9.82442 18.5953 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 4.3247 6.63733 5.76452 4.5892 5.88927 3.07021 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 8.89769 7.31364 11.0377 6.82267 7.93893 3.43966 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.43112 7.49352 6.32315 9.3873 3.69477 8.20112 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 8.30857 5.21801 4.02702 7.667 5.71136 3.5168 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 6.65725 9.07247 4.67256 9.511 4.79971 8.73 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 6.65725 9.07247 4.67256 7.72354 5.05856 9.71065 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.59836 7.86997 6.3369 9.08818 11.9472 6.43304 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 7.59836 7.86997 6.3369 7.93563 3.74763 7.36003 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 7.59836 7.86997 6.3369 5.70056 4.4787 3.2635 numMergedOcc 0
20 mol 186 unq 3 iso 0 dist 7.59836 6.80944 8.54288 9.08818 11.9472 4.46688 numMergedOcc 0
21 mol 186 unq 4 iso 0 dist 7.59836 6.80944 8.54288 7.93563 3.74763 9.6068 numMergedOcc 0
22 mol 186 unq 5 iso 0 dist 7.59836 6.80944 8.54288 5.70056 4.4787 4.9849 numMergedOcc 0
23 mol 186 unq 6 iso 0 dist 9.94274 7.86997 11.7617 9.08818 14.7313 6.43304 numMergedOcc 0
24 mol 186 unq 7 iso 0 dist 9.94274 7.86997 11.7617 7.93563 4.87674 7.36003 numMergedOcc 0
25 mol 186 unq 8 iso 0 dist 9.94274 7.86997 11.7617 5.70056 8.72129 3.2635 numMergedOcc 0
26 mol 186 unq 9 iso 0 dist 9.94274 6.80944 13.4501 9.08818 14.7313 4.46688 numMergedOcc 0
27 mol 186 unq 10 iso 0 dist 9.94274 6.80944 13.4501 7.93563 4.87674 9.6068 numMergedOcc 0
28 mol 186 unq 11 iso 0 dist 9.94274 6.80944 13.4501 5.70056 8.72129 4.9849 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 8.06003 9.94612 6.82259 5.04072 8.44353 12.6421 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 8.06003 9.94612 6.82259 8.67956 3.95528 3.30455 numMergedOcc 0
31 mol 279 unq 0 iso 0 dist 7.10052 5.41277 8.8363 5.76793 5.21917 9.19808 numMergedOcc 0
32 mol 279 unq 1 iso 0 dist 7.10052 5.41277 8.8363 7.72276 9.79726 3.36713 numMergedOcc 0
33 mol 281 unq 0 iso 0 dist 9.81562 9.68114 5.40628 9.04679 5.31724 3.3309 numMergedOcc 0
34 mol 283 unq 0 iso 0 dist 9.06675 5.63358 3.97454 6.69403 8.59329 6.18318 numMergedOcc 0
35 mol 283 unq 1 iso 0 dist 9.06675 5.63358 3.97454 5.76694 6.1459 3.34167 numMergedOcc 0
36 mol 285 unq 0 iso 0 dist 9.23037 9.26793 6.3633 8.38399 8.78384 3.14843 numMergedOcc 0
